(1-Cyclopentylpyrrolidin-3-yl)methanol

CAS Number: 1017429-88-7
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OCC(CC1)CN1C1CCCC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H19NO
Molecular Weight
169.267
Drug-likeness
-2.5494
CAS
1017429-88-7
InChI key
FJFRWUWFQYXXNP-VIFPVBQESA-N
SMILES
OCC(CC1)CN1C1CCCC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1017429-88-7
Molecule Name (1-Cyclopentylpyrrolidin-3-yl)methanol
Molecular Formula C10H19NO
SMILES OCC(CC1)CN1C1CCCC1
InChI InChI=1S/C10H19NO/c12-8-9-5-6-11(7-9)10-3-1-2-4-10/h9-10,12H,1-8H2/t9-/m0/s1
InChI Key FJFRWUWFQYXXNP-VIFPVBQESA-N
CanonicalSyTyLFy 44609e7199847ec5
TotalMolweight 169.267
Molecular Weight 169.267
MonoisotopicMass 169.146664
CLogP 1.2117
CLogS -1.45
H Acceptors 2
H Donors 1
TotalSurfaceArea 138.23
Relative PSA 0.12045
PolarSurfaceArea 23.47
Drug-likeness -2.5494
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecula Flexibility 0.42546
Molecular Complexity 0.62687
Fragments 1
Non HAtoms 12
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 2
Rings Closures 2
Small Rings 2
Sp3Atoms 12
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon racemate

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