(R)-2-methylpyrrolidine hydrochloride

CAS Number: 135324-85-5
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C[C@H]1NCCC1.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C5H11N
Molecular Weight
85.1493
Drug-likeness
2.5985
CAS
135324-85-5
InChI key
JNEIFWYJFOEKIM-NUBCRITNSA-N
SMILES
C[C@H]1NCCC1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 135324-85-5
Molecule Name (R)-2-methylpyrrolidine hydrochloride
Molecular Formula HCl.C5H11N
SMILES C[C@H]1NCCC1.Cl
InChI InChI=1S/C5H11N.ClH/c1-5-3-2-4-6-5;/h5-6H,2-4H2,1H3;1H/t5-;/m1./s1
InChI Key JNEIFWYJFOEKIM-NUBCRITNSA-N
CanonicalSyTyLFy 4ca81d7126324e1f
TotalMolweight 121.61
Molecular Weight 85.1493
MonoisotopicMass 85.089149
CLogP 0.7272
CLogS -1.233
H Acceptors 1
H Donors 1
TotalSurfaceArea 77.5
Relative PSA 0.14787
PolarSurfaceArea 12.03
Drug-likeness 2.5985
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecular Complexity 0.59725
Fragments 2
Non HAtoms 6
NonCHAtoms 1
Electronegative Atoms 1
StereoCenters 1
Rings Closures 1
Small Rings 1
Sp3Atoms 6
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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