N-(2-methylphenyl)-1H-pyrrole-2-carboxamide

C12H12N2O — CID 47009571

IUPACN-(2-methylphenyl)-1H-pyrrole-2-carboxamide
SMILESCc1ccccc1NC(=O)c1ccc[nH]1
InChIInChI=1S/C12H12N2O/c1-9-5-2-3-6-10(9)14-12(15)11-7-4-8-13-11/h2-8,13H,1H3,(H,14,15)
InChIKeyRJPFSYBRXZJLTL-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.58
Rot. Bonds2

About N-(2-methylphenyl)-1H-pyrrole-2-carboxamide

N-(2-methylphenyl)-1H-pyrrole-2-carboxamide (PubChem CID 47009571) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is N-(2-methylphenyl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-1H-pyrrole-2-carboxamide
PubChem CID47009571
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC NameN-(2-methylphenyl)-1H-pyrrole-2-carboxamide
SMILESCc1ccccc1NC(=O)c1ccc[nH]1
InChIInChI=1S/C12H12N2O/c1-9-5-2-3-6-10(9)14-12(15)11-7-4-8-13-11/h2-8,13H,1H3,(H,14,15)
InChIKeyRJPFSYBRXZJLTL-UHFFFAOYSA-N
XLogP2.58
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze N-(2-methylphenyl)-1H-pyrrole-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

N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
CID 51210810
N-naphthalen-1-yl-1H-pyrrole-2-carboxamide
CID 110461074
N-(2-methylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261390
N-[2-(methylaminomethyl)phenyl]-1H-pyrrole-2-carboxamide
CID 43601088
[2-(2-methylanilino)-2-oxoethyl] 1H-pyrrole-2-carboxylate
CID 8543923
bis(N-[2-(1H-pyrrole-2-carbonylamino)phenyl]-1H-pyrrole-2-carboxamide);bis(tetrabutylazanium);difluoride
CID 139175498
ethane;4-methyl-N-(2-methylphenyl)benzamide
CID 145337643
N-[2-(cyclopenta-1,3-dien-1-ylcarbamoylamino)phenyl]-1H-pyrrole-2-carboxamide
CID 102395215
N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
CID 63107622
4-tert-butyl-N-(2-methylphenyl)benzamide
CID 139185103
4-N-(2,6-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049294
2,6-dihydroxy-N-(2-methylphenyl)benzamide
CID 113347043

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-1H-pyrrole-2-carboxamide?
The IUPAC name of N-(2-methylphenyl)-1H-pyrrole-2-carboxamide (CID 47009571) is N-(2-methylphenyl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-1H-pyrrole-2-carboxamide is Cc1ccccc1NC(=O)c1ccc[nH]1.
What is the InChIKey of N-(2-methylphenyl)-1H-pyrrole-2-carboxamide?
The InChIKey is RJPFSYBRXZJLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-5-2-3-6-10(9)14-12(15)11-7-4-8-13-11/h2-8,13H,1H3,(H,14,15).
What are the key properties of N-(2-methylphenyl)-1H-pyrrole-2-carboxamide?
N-(2-methylphenyl)-1H-pyrrole-2-carboxamide has a molecular weight of 200.24 g/mol, XLogP of 2.58, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 47009571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).