1000 78 8 | Cheminformatics

6-[(E)-(2,2-Dimethylpropylidene)amino]hexan-1-amine

Formula:C11H24N2 CAS:1000-78-8

PropertyValue
Casrn1000-78-8
MolName6-[(E)-(2,2-Dimethylpropylidene)amino]hexan-1-amine
MolecularFormulaC11H24N2
SmilesCC(C)(C)/C=N/CCCCCCN
InChIInChI=1S/C11H24N2/c1-11(2,3)10-13-9-7-5-4-6-8-12/h10H,4-9,12H2,1-3H3/b13-10+
InChIKJWCJQYFAOGUPJT-JLHYYAGUSA-N
CanonicalSyTyLFyf9258a03837679a0
TotalMolweight184.326
Molweight184.326
MonoisotopicMass184.193948
CLogP2.1025
CLogS-2.304
H Acceptors2
H Donors1
TotalSurfaceArea176.53
Relative PSA0.1517
PolarSurfaceArea38.38
Druglikeness-10.254
Mutagenichigh
Tumorigeniclow
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.84615
Molecula Flexibility0.62367
Molecular Complexity0.32432
Fragments1
Non HAtoms13
NonCHAtoms2
Electronegative Atoms2
Rotatable Bond7
Sp3Atoms11
Symmetricatoms2
Amines1
AlkylAmines1
BasicNitrogens2
StereoCon
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100-10-7nonehighhighC9H11NO149.192-1.8715
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
1000160-97-3nonenonenoneC24H28N2O3.C11H8O3392.4971.9926
100-48-1nonenonenoneC6H4N2104.112-6.0498
1000018-39-2highhighlowC13H20N2O2S268.381.9315
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436
100-53-8nonehighhighC7H8S124.207-6.3177
100-34-5nonenonenoneCl.C6H5N2105.12-4.365
1000017-92-4nonenonenoneC6H4NBr2Cl285.366-3.6
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
100011-00-5nonenonenoneC15H24O2236.354-18.044
100-75-4highhighhighC5H10N2O114.147-0.86877
1000339-36-5nonenonenoneC16H19NO3S305.397-3.4866
1000018-70-1nonenonenoneC15H18N2O6322.316-6.5762
1000-84-6nonenonehighC4H9NO87.1215-6.3779
100-64-1highhighnoneC6H11NO113.159-6.4182
1000017-97-9nonenonenoneC10H11N3O2205.216-1.3937
100019-40-7nonenonenoneC14H15NO3245.277-1.947
1000-56-2nonenonenoneC3H7O4S.Na139.151-6.9141
100-15-2nonehighnoneC7H8N2O2152.153-5.7806
1000269-65-7nonenonenoneC12H19N3205.3040.25629
100-90-3nonenonenoneC14H16N4O3S320.3724.7301
1000018-24-5nonenonenoneC12H18N4O3266.3-0.33651
100-50-5nonenonehighC7H10O110.155-9.6048
10-00-4nonenonenoneC28H34O8498.57-4.8409
10000-42-7highhighlowC20H18N4O3362.388-5.7793
1000018-52-9nonenonenoneC11H12N2O2S2268.361.3179
100016-58-8nonehighnoneC19H19NO5341.3621.8385
10-31-2001nonenonenoneC21H28NO6P421.428-10.542
1000-05-1nonenonehighC8H26O3Si4282.635-83.299
1000010-11-6nonenonenoneC28H44N2O2440.669-21.689
100021-05-4nonenonenoneC21H28O2312.4510.95307
100027-33-6nonenonenoneI.C21H27N2O323.4583.6949
10001-82-8nonenonenoneC24H26N4O5S482.5599.4242
100-89-0nonenonelowC18H36O6B2370.1-16.157
1000-57-3highnonelowC6H16SSn238.969-7.4261
1000339-24-1nonenonenoneC7H4NOF137.113-7.3916
100009-23-2nonenonehighC17H22226.362-9.7346
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
100-96-9highnonenoneC7H10N2O138.169-1.7412
10001-52-2highhighnoneC11H10N6O3S306.3056.7202
100021-47-4nonenonenoneC13H17N5O6339.307-2.7249
1000339-32-1nonenonenoneC11H14NF179.2370.6275
100-16-3lowhighnoneC6H7N3O2153.141-9.8627
100-66-3highnonehighC7H8O108.14-2.0846
1000160-96-2nonenonenoneC24H28N2O3.C2H4O2392.4971.9926
100-59-4nonenonenoneCl.C6H5Mg101.411-2.3575
100004-95-3nonenonenoneC13H11NO3229.234-1.3547
100010-00-2nonenonenoneC20H23NO5357.405-3.7157
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
1000339-31-0nonenonehighC12H16NCl209.7190.65299
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
1000025-59-1nonenonenoneC14H11O3Cl262.691-1.449
1000339-33-2nonenonenoneC10H11NClF199.6550.76
10001-51-1nonenonenoneC9H18N2O170.2555.9677
100023-32-3highhighnoneCH3O4S.C20H19N2O303.3840.7545
100020-34-6nonenonenoneC13H18S2238.418-0.23079
1000-68-6nonenonenoneC3H9NO3S2171.24-3.0843
1000068-65-4nonenonenoneC13H15NO4BF279.074-46.077
100-67-4nonenonenoneK.C6H5O93.1047-2.2548