(4-Fluoro-1-methylpiperidin-4-yl)methanol

CAS Number: 1000341-04-7
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CN(CC1)CCC1(CO)F
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C7H14NOF
Molecular Weight
147.192
Drug-likeness
2.1102
CAS
1000341-04-7
InChI key
ZACQKYSISKMVCF-UHFFFAOYSA-N
SMILES
CN(CC1)CCC1(CO)F
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1000341-04-7
Molecule Name (4-Fluoro-1-methylpiperidin-4-yl)methanol
Molecular Formula C7H14NOF
SMILES CN(CC1)CCC1(CO)F
InChI InChI=1S/C7H14FNO/c1-9-4-2-7(8,6-10)3-5-9/h10H,2-6H2,1H3
InChI Key ZACQKYSISKMVCF-UHFFFAOYSA-N
CanonicalSyTyLFy 29dc8b28043dbb65
TotalMolweight 147.192
Molecular Weight 147.192
MonoisotopicMass 147.105942
CLogP 0.2177
CLogS -0.548
H Acceptors 2
H Donors 1
TotalSurfaceArea 114.47
Relative PSA 0.14545
PolarSurfaceArea 23.47
Drug-likeness 2.1102
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.7
Molecula Flexibility 0.35201
Molecular Complexity 0.58889
Fragments 1
Non HAtoms 10
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Sp3Atoms 9
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1

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