(1R,2R)-2-(Pyrrolidin-1-yl)cyclopentan-1-ol

CAS Number: 32635-39-5
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O[C@H](CCC1)[C@@H]1N1CCCC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C9H17NO
Molecular Weight
155.24
Drug-likeness
2.4072
CAS
32635-39-5
InChI key
YUKHVOQROHUFMM-RKDXNWHRSA-N
SMILES
O[C@H](CCC1)[C@@H]1N1CCCC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 32635-39-5
Molecule Name (1R,2R)-2-(Pyrrolidin-1-yl)cyclopentan-1-ol
Molecular Formula C9H17NO
SMILES O[C@H](CCC1)[C@@H]1N1CCCC1
InChI InChI=1S/C9H17NO/c11-9-5-3-4-8(9)10-6-1-2-7-10/h8-9,11H,1-7H2/t8-,9-/m1/s1
InChI Key YUKHVOQROHUFMM-RKDXNWHRSA-N
CanonicalSyTyLFy 2095fa61136f9b38
TotalMolweight 155.24
Molecular Weight 155.24
MonoisotopicMass 155.131014
CLogP 1.017
CLogS -1.398
H Acceptors 2
H Donors 1
TotalSurfaceArea 124.47
Relative PSA 0.13377
PolarSurfaceArea 23.47
Drug-likeness 2.4072
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.54545
Molecula Flexibility 0.37837
Molecular Complexity 0.62294
Fragments 1
Non HAtoms 11
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 2
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Sp3Atoms 11
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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