(2S)-2-(4-chlorophenyl)pyrrolidine

C10H12ClN — CID 7009380

IUPAC(2S)-2-(4-chlorophenyl)pyrrolidine
SMILESClc1ccc([C@@H]2CCCN2)cc1
InChIInChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2/t10-/m0/s1
InChIKeyCIHHGGKKRPPWSU-JTQLQIEISA-N
MW181.67 g/mol
LogP2.76
Rot. Bonds1

About (2S)-2-(4-chlorophenyl)pyrrolidine

(2S)-2-(4-chlorophenyl)pyrrolidine (PubChem CID 7009380) has the molecular formula C10H12ClN and a molecular weight of 181.67 g/mol. Its IUPAC name is (2S)-2-(4-chlorophenyl)pyrrolidine.

Molecular Properties

Compound Name(2S)-2-(4-chlorophenyl)pyrrolidine
PubChem CID7009380
Molecular FormulaC10H12ClN
Molecular Weight181.67 g/mol
Exact Mass181.07
IUPAC Name(2S)-2-(4-chlorophenyl)pyrrolidine
SMILESClc1ccc([C@@H]2CCCN2)cc1
InChIInChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2/t10-/m0/s1
InChIKeyCIHHGGKKRPPWSU-JTQLQIEISA-N
XLogP2.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.67
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2S)-2-(4-chlorophenyl)pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chlorophenyl)pyrrolidine;ethane
CID 177172941
(2R)-2-(4-chlorophenyl)piperidine;hydrochloride
CID 155903197
(2R)-2-(4-methylphenyl)pyrrolidine
CID 7047871
(2R)-2-[4-(4-methylphenyl)phenyl]pyrrolidine
CID 66519668
2-(4-pyrrolidin-3-ylphenyl)pyrrolidine
CID 116988431
2-(3-bromo-4-chlorophenyl)pyrrolidine
CID 53403563
(2S)-2-(4-chloro-3-methylphenyl)pyrrolidine
CID 55253037
4-piperidin-2-ylphenol
CID 19711202
4-[(2R)-pyrrolidin-2-yl]pyridine;hydrochloride
CID 171195835
(2S)-2-(4-bromophenyl)piperidine
CID 7022866
(2R)-2-[3-(difluoromethyl)-4-fluorophenyl]pyrrolidine
CID 66518805
(2S)-2-(3-bromo-4-chlorophenyl)pyrrolidine;hydrochloride
CID 171196289

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-chlorophenyl)pyrrolidine?
The IUPAC name of (2S)-2-(4-chlorophenyl)pyrrolidine (CID 7009380) is (2S)-2-(4-chlorophenyl)pyrrolidine.
What is the SMILES notation for (2S)-2-(4-chlorophenyl)pyrrolidine?
The canonical SMILES for (2S)-2-(4-chlorophenyl)pyrrolidine is Clc1ccc([C@@H]2CCCN2)cc1.
What is the InChIKey of (2S)-2-(4-chlorophenyl)pyrrolidine?
The InChIKey is CIHHGGKKRPPWSU-JTQLQIEISA-N. The full InChI is InChI=1S/C10H12ClN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6,10,12H,1-2,7H2/t10-/m0/s1.
What are the key properties of (2S)-2-(4-chlorophenyl)pyrrolidine?
(2S)-2-(4-chlorophenyl)pyrrolidine has a molecular weight of 181.67 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-chlorophenyl)pyrrolidine is sourced from PubChem (CID 7009380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).