2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide

C14H19ClN2O — CID 119514159

IUPAC2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCC1CCCN1)c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O/c1-10(11-4-2-5-12(15)8-11)14(18)17-9-13-6-3-7-16-13/h2,4-5,8,10,13,16H,3,6-7,9H2,1H3,(H,17,18)
InChIKeyYIRALAXNLAUFEV-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.31
Rot. Bonds4

About 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide

2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide (PubChem CID 119514159) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide
PubChem CID119514159
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCC1CCCN1)c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O/c1-10(11-4-2-5-12(15)8-11)14(18)17-9-13-6-3-7-16-13/h2,4-5,8,10,13,16H,3,6-7,9H2,1H3,(H,17,18)
InChIKeyYIRALAXNLAUFEV-UHFFFAOYSA-N
XLogP2.31
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide 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-phenyl-N-(piperidin-2-ylmethyl)propanamide
CID 114028770
2-(2,5-dichlorophenyl)sulfanyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 119512562
2-[2-(3-chlorophenyl)-2-fluoroethyl]pyrrolidine
CID 105485071
2-(5-chlorothiophen-2-yl)-N-(pyrrolidin-2-ylmethyl)propanamide;hydrochloride
CID 119510927
1-(3-chlorophenyl)-2-piperidin-2-ylethanol
CID 79559914
(2R)-2-hydroxy-N-(pyrrolidin-2-ylmethyl)propanamide
CID 126992577
(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide
CID 130985831
N-(2-aminoethyl)-2-(3-chlorophenyl)propanamide;hydrochloride
CID 119385148
1-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)cyclopropane-1-carboxamide
CID 119509968
1-(3-chlorophenyl)-5-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide
CID 119511365
2-(3-aminophenyl)-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 106591529
2-[ethyl(methyl)amino]-2-phenyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119513409

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide (CID 119514159) is 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide is CC(C(=O)NCC1CCCN1)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide?
The InChIKey is YIRALAXNLAUFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-10(11-4-2-5-12(15)8-11)14(18)17-9-13-6-3-7-16-13/h2,4-5,8,10,13,16H,3,6-7,9H2,1H3,(H,17,18).
What are the key properties of 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide?
2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide has a molecular weight of 266.77 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(pyrrolidin-2-ylmethyl)propanamide is sourced from PubChem (CID 119514159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).