N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide

C16H15N3O — CID 110469037

IUPACN,1-dimethyl-N-phenylbenzimidazole-2-carboxamide
SMILESCN(C(=O)c1nc2ccccc2n1C)c1ccccc1
InChIInChI=1S/C16H15N3O/c1-18(12-8-4-3-5-9-12)16(20)15-17-13-10-6-7-11-14(13)19(15)2/h3-11H,1-2H3
InChIKeyVNEYJNOYZFIURF-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.85
Rot. Bonds2

About N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide

N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide (PubChem CID 110469037) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-phenylbenzimidazole-2-carboxamide
PubChem CID110469037
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN,1-dimethyl-N-phenylbenzimidazole-2-carboxamide
SMILESCN(C(=O)c1nc2ccccc2n1C)c1ccccc1
InChIInChI=1S/C16H15N3O/c1-18(12-8-4-3-5-9-12)16(20)15-17-13-10-6-7-11-14(13)19(15)2/h3-11H,1-2H3
InChIKeyVNEYJNOYZFIURF-UHFFFAOYSA-N
XLogP2.85
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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1-(1-methylbenzimidazol-2-yl)pentane-1,3-dione
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N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide
CID 86792862
N-methyl-N-phenylcinnoline-3-carboxamide
CID 110705116
N-[(E)-1-(1-methylbenzimidazol-2-yl)ethylideneamino]aniline
CID 134100687
N-[1-(1-methylbenzimidazol-2-yl)ethylideneamino]benzamide
CID 3968667
N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide
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(1-methylbenzimidazol-2-yl)-pyridin-3-ylmethanone
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(Z)-[(1-methylbenzimidazol-2-yl)-phenylmethylidene]hydrazine
CID 177414906

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide?
The IUPAC name of N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide (CID 110469037) is N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide?
The canonical SMILES for N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide is CN(C(=O)c1nc2ccccc2n1C)c1ccccc1.
What is the InChIKey of N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide?
The InChIKey is VNEYJNOYZFIURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-18(12-8-4-3-5-9-12)16(20)15-17-13-10-6-7-11-14(13)19(15)2/h3-11H,1-2H3.
What are the key properties of N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide?
N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide is sourced from PubChem (CID 110469037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).