N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide

C16H18N4O — CID 86792862

IUPACN,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide
SMILESCc1ccc(C(=O)N(C)c2nc3ccccc3n2C)n1C
InChIInChI=1S/C16H18N4O/c1-11-9-10-14(18(11)2)15(21)20(4)16-17-12-7-5-6-8-13(12)19(16)3/h5-10H,1-4H3
InChIKeyPIXNTASCOGAIFJ-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.50
Rot. Bonds2

About N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide

N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide (PubChem CID 86792862) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide.

Molecular Properties

Compound NameN,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide
PubChem CID86792862
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC NameN,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide
SMILESCc1ccc(C(=O)N(C)c2nc3ccccc3n2C)n1C
InChIInChI=1S/C16H18N4O/c1-11-9-10-14(18(11)2)15(21)20(4)16-17-12-7-5-6-8-13(12)19(16)3/h5-10H,1-4H3
InChIKeyPIXNTASCOGAIFJ-UHFFFAOYSA-N
XLogP2.50
TPSA43.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide
CID 86792753
4-cyclopropyl-N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)pyrimidine-5-carboxamide
CID 136539953
N-methyl-N-(1-methylbenzimidazol-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 154736677
N-methyl-N-(1-methylbenzimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 86792736
N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide
CID 110469037
2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide
CID 86792738
sodium 1-methylbenzimidazole-2-carboxylate
CID 131637939
1,2-dimethylbenzimidazole;formaldehyde;methanol
CID 90743807
5-[methyl-(1-methylbenzimidazol-2-yl)amino]pentan-1-ol
CID 107203489
N-butyl-N,1-dimethylbenzimidazol-2-amine
CID 71723450
N,1-dimethyl-N-(2-phenylethyl)benzimidazol-2-amine
CID 115144055
N-[(1Z)-buta-1,3-dienyl]-N,1-dimethylbenzimidazol-2-amine
CID 155173890

Frequently Asked Questions

What is the IUPAC name of N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide?
The IUPAC name of N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide (CID 86792862) is N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide.
What is the SMILES notation for N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide?
The canonical SMILES for N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide is Cc1ccc(C(=O)N(C)c2nc3ccccc3n2C)n1C.
What is the InChIKey of N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide?
The InChIKey is PIXNTASCOGAIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-11-9-10-14(18(11)2)15(21)20(4)16-17-12-7-5-6-8-13(12)19(16)3/h5-10H,1-4H3.
What are the key properties of N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide?
N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide has a molecular weight of 282.35 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide is sourced from PubChem (CID 86792862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).