2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide

C13H18N2O — CID 43603662

IUPAC2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
SMILESCc1ccc(CC(=O)NC2CCNC2)cc1
InChIInChI=1S/C13H18N2O/c1-10-2-4-11(5-3-10)8-13(16)15-12-6-7-14-9-12/h2-5,12,14H,6-9H2,1H3,(H,15,16)
InChIKeyAZXJZVKDGMNJFZ-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.02
Rot. Bonds3

About 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide

2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide (PubChem CID 43603662) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
PubChem CID43603662
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide
SMILESCc1ccc(CC(=O)NC2CCNC2)cc1
InChIInChI=1S/C13H18N2O/c1-10-2-4-11(5-3-10)8-13(16)15-12-6-7-14-9-12/h2-5,12,14H,6-9H2,1H3,(H,15,16)
InChIKeyAZXJZVKDGMNJFZ-UHFFFAOYSA-N
XLogP1.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide 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-methylphenyl)-N-[(3R)-piperidin-3-yl]acetamide
CID 113436646
4-(4-methylphenyl)-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 119453431
2-(4-chlorophenyl)-N-pyrrolidin-3-ylacetamide
CID 62379159
2-phenyl-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688083
2-(4-methylphenoxy)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 94803257
N-[(3S)-pyrrolidin-3-yl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 79688212
2-(4-methylphenoxy)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119450091
N-[(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-yl]-2-(4-methylphenyl)acetamide
CID 43603845
N-pyrrolidin-3-yl-2-[4-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119452098
4-[4-[2-(methylamino)-2-oxoethyl]phenyl]-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 126445059
2-[4-(difluoromethoxy)phenyl]-N-pyrrolidin-3-ylacetamide
CID 119451451
2-(3,4-dimethylphenyl)-N-[(3S)-piperidin-3-yl]acetamide
CID 94471135

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide?
The IUPAC name of 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide (CID 43603662) is 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide is Cc1ccc(CC(=O)NC2CCNC2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide?
The InChIKey is AZXJZVKDGMNJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-2-4-11(5-3-10)8-13(16)15-12-6-7-14-9-12/h2-5,12,14H,6-9H2,1H3,(H,15,16).
What are the key properties of 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide?
2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide has a molecular weight of 218.30 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-pyrrolidin-3-ylacetamide is sourced from PubChem (CID 43603662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).