N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide

C16H16N4O — CID 46540923

IUPACN-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide
SMILESCCn1c(NC(=O)c2cccc(C)n2)nc2ccccc21
InChIInChI=1S/C16H16N4O/c1-3-20-14-10-5-4-8-12(14)18-16(20)19-15(21)13-9-6-7-11(2)17-13/h4-10H,3H2,1-2H3,(H,18,19,21)
InChIKeyZGBIRWNABYKQJX-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.01
Rot. Bonds3

About N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide

N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide (PubChem CID 46540923) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide
PubChem CID46540923
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide
SMILESCCn1c(NC(=O)c2cccc(C)n2)nc2ccccc21
InChIInChI=1S/C16H16N4O/c1-3-20-14-10-5-4-8-12(14)18-16(20)19-15(21)13-9-6-7-11(2)17-13/h4-10H,3H2,1-2H3,(H,18,19,21)
InChIKeyZGBIRWNABYKQJX-UHFFFAOYSA-N
XLogP3.01
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 27897993
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5-chloro-N-(1-ethylbenzimidazol-2-yl)-2-methoxybenzamide
CID 27898030
N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide
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N'-(3-ethyl-4-oxoquinazolin-2-yl)-6-methylpyridine-2-carbohydrazide
CID 134001910
(1-ethylbenzimidazol-2-yl)carbamoyl acetate
CID 127259054
1-methyl-6-oxo-N-(1-propylbenzimidazol-2-yl)pyridazine-3-carboxamide
CID 4879642
N-(1-ethylbenzimidazol-2-yl)-3,4,5-trimethoxybenzamide
CID 17417130
N-(1-ethylbenzimidazol-2-yl)-13-methyl-10-oxo-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8-tetraene-4-carboxamide
CID 77479125
3-amino-N-(1-ethylbenzimidazol-2-yl)butanamide
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CID 46970461

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide (CID 46540923) is N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide is CCn1c(NC(=O)c2cccc(C)n2)nc2ccccc21.
What is the InChIKey of N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide?
The InChIKey is ZGBIRWNABYKQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-3-20-14-10-5-4-8-12(14)18-16(20)19-15(21)13-9-6-7-11(2)17-13/h4-10H,3H2,1-2H3,(H,18,19,21).
What are the key properties of N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide?
N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 46540923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).