1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide

C13H14N2O — CID 110762711

IUPAC1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccn(C)c2)c1
InChIInChI=1S/C13H14N2O/c1-10-4-3-5-12(8-10)14-13(16)11-6-7-15(2)9-11/h3-9H,1-2H3,(H,14,16)
InChIKeyDIKIWAMNDFZLSN-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.59
Rot. Bonds2

About 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide

1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide (PubChem CID 110762711) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide
PubChem CID110762711
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide
SMILESCc1cccc(NC(=O)c2ccn(C)c2)c1
InChIInChI=1S/C13H14N2O/c1-10-4-3-5-12(8-10)14-13(16)11-6-7-15(2)9-11/h3-9H,1-2H3,(H,14,16)
InChIKeyDIKIWAMNDFZLSN-UHFFFAOYSA-N
XLogP2.59
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-methyl-N-(3-methylphenyl)pyrrole-3-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

1-methyl-N-phenylpyrrole-3-carboxamide
CID 110762710
1,3-dimethyl-N-(3-methylphenyl)-2,4-dioxopyrimidine-5-carboxamide
CID 84551318
N-(3-methylphenyl)furan-3-carboxamide
CID 27007768
N-(3,4-dichlorophenyl)-1-methylpyrrole-3-carboxamide
CID 110863945
2,6-dihydroxy-N-(3-methylphenyl)benzamide
CID 103748871
1-N-methyl-3-N-(3-methylphenyl)benzene-1,3-dicarboxamide
CID 58018070
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)carbamoyl]phenoxy]benzamide
CID 3539312
3-[(3-methylphenyl)carbamoyl]benzoyl chloride
CID 101097986
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
N-(3-methylphenyl)-6-oxopyran-3-carboxamide
CID 110697514
N-(3-acetamidophenyl)-3-methylbenzamide
CID 766081
1-N-(4-fluorophenyl)-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109049357

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide?
The IUPAC name of 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide (CID 110762711) is 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide?
The canonical SMILES for 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide is Cc1cccc(NC(=O)c2ccn(C)c2)c1.
What is the InChIKey of 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide?
The InChIKey is DIKIWAMNDFZLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-4-3-5-12(8-10)14-13(16)11-6-7-15(2)9-11/h3-9H,1-2H3,(H,14,16).
What are the key properties of 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide?
1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide has a molecular weight of 214.27 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-methylphenyl)pyrrole-3-carboxamide is sourced from PubChem (CID 110762711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).