(1E)-N-Cyclohexylpentan-1-imine

CAS Number: 41807-65-2
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CCCC/C=N/C1CCCCC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C11H21N
Molecular Weight
167.295
Drug-likeness
-10.621
CAS
41807-65-2
InChI key
YWKORKMTXGZSCA-ZRDIBKRKSA-N
SMILES
CCCC/C=N/C1CCCCC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 41807-65-2
Molecule Name (1E)-N-Cyclohexylpentan-1-imine
Molecular Formula C11H21N
SMILES CCCC/C=N/C1CCCCC1
InChI InChI=1S/C11H21N/c1-2-3-7-10-12-11-8-5-4-6-9-11/h10-11H,2-9H2,1H3/b12-10+
InChI Key YWKORKMTXGZSCA-ZRDIBKRKSA-N
CanonicalSyTyLFy a9cda573739e3762
TotalMolweight 167.295
Molecular Weight 167.295
MonoisotopicMass 167.167399
CLogP 2.8835
CLogS -3.132
H Acceptors 1
TotalSurfaceArea 159.6
Relative PSA 0.072118
PolarSurfaceArea 12.36
Drug-likeness -10.621
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions imine/hydrazone of aldehyde
Shape Index 0.83333
Molecula Flexibility 0.40729
Molecular Complexity 0.42749
Fragments 1
Non HAtoms 12
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 4
Rings Closures 1
Small Rings 1
Sp3Atoms 10
Symmetricatoms 2
BasicNitrogens 1

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