1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide

C13H18N2O — CID 110856789

IUPAC1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN2C)cc1
InChIInChI=1S/C13H18N2O/c1-10-5-7-11(8-6-10)14-13(16)12-4-3-9-15(12)2/h5-8,12H,3-4,9H2,1-2H3,(H,14,16)
InChIKeyFHARHSCJEOABQM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.03
Rot. Bonds2

About 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide

1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide (PubChem CID 110856789) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
PubChem CID110856789
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
SMILESCc1ccc(NC(=O)C2CCCN2C)cc1
InChIInChI=1S/C13H18N2O/c1-10-5-7-11(8-6-10)14-13(16)12-4-3-9-15(12)2/h5-8,12H,3-4,9H2,1-2H3,(H,14,16)
InChIKeyFHARHSCJEOABQM-UHFFFAOYSA-N
XLogP2.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide 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

(2S)-1-acetyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide
CID 784723
1-methyl-N-[4-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 110860923
(2R)-N-(4-methylphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide
CID 1084740
[4-[(1-methylpyrrolidine-2-carbonyl)amino]phenyl]methyl 2-methylpropanoate
CID 171546002
phenyl 2-[(4-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate
CID 655757
N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110856788
N-[4-(4-methylphenoxy)phenyl]-1-methylsulfonylpyrrolidine-2-carboxamide
CID 55429298
(2R)-2-N-(3,4-dimethylphenyl)-1-N-(4-methylphenyl)pyrrolidine-1,2-dicarboxamide
CID 51684738
1-(4-methylphenyl)sulfonyl-N-(4-methylsulfonylphenyl)pyrrolidine-2-carboxamide
CID 16827882
(2S)-1-(4-methylbenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 92668343
(2S)-N-[4-[3-(4-aminophenyl)propylamino]phenyl]-1-methylpyrrolidine-2-carboxamide
CID 176904802
(2S)-1-(2-fluorobenzoyl)-N-(4-methylphenyl)pyrrolidine-2-carboxamide
CID 92668196

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide (CID 110856789) is 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide is Cc1ccc(NC(=O)C2CCCN2C)cc1.
What is the InChIKey of 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide?
The InChIKey is FHARHSCJEOABQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-5-7-11(8-6-10)14-13(16)12-4-3-9-15(12)2/h5-8,12H,3-4,9H2,1-2H3,(H,14,16).
What are the key properties of 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide?
1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide has a molecular weight of 218.30 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-methylphenyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 110856789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).