N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide

C21H17ClN4O2 — CID 99718321

IUPACN-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2nc3cc(Cl)ccc3n2C)cc1-c1ccccn1
InChIInChI=1S/C21H17ClN4O2/c1-26-18-8-7-14(22)12-17(18)24-21(26)25-20(27)13-6-9-19(28-2)15(11-13)16-5-3-4-10-23-16/h3-12H,1-2H3,(H,24,25,27)
InChIKeyZEXMVQXEMMMDFD-UHFFFAOYSA-N
MW392.85 g/mol
LogP4.55
Rot. Bonds4

About N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide

N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide (PubChem CID 99718321) has the molecular formula C21H17ClN4O2 and a molecular weight of 392.85 g/mol. Its IUPAC name is N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide
PubChem CID99718321
Molecular FormulaC21H17ClN4O2
Molecular Weight392.85 g/mol
Exact Mass392.10
IUPAC NameN-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2nc3cc(Cl)ccc3n2C)cc1-c1ccccn1
InChIInChI=1S/C21H17ClN4O2/c1-26-18-8-7-14(22)12-17(18)24-21(26)25-20(27)13-6-9-19(28-2)15(11-13)16-5-3-4-10-23-16/h3-12H,1-2H3,(H,24,25,27)
InChIKeyZEXMVQXEMMMDFD-UHFFFAOYSA-N
XLogP4.55
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.85
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-(5-methoxy-1,3-dimethylpyrazol-4-yl)-3-pyridin-2-ylbenzamide
CID 99576828
methyl 4-methoxy-3-pyridin-2-ylbenzoate
CID 70840507
4-methoxy-N-(3-methyl-1,2,4-thiadiazol-5-yl)-3-pyridin-2-ylbenzamide
CID 75389227
N-(5-chloro-1-methylbenzimidazol-2-yl)-6-ethoxypyridine-3-carboxamide
CID 86868002
N-(4-hydroxy-2,2-dimethylpentyl)-4-methoxy-3-pyridin-2-ylbenzamide
CID 109399395
6-chloro-N-(3,4-dimethoxyphenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 2220682
(2S,3S)-2-[(4-methoxy-3-pyridin-2-ylbenzoyl)amino]-3-methylpentanoic acid
CID 120517382
N-[1-(hydroxymethyl)cyclopentyl]-4-methoxy-3-pyridin-2-ylbenzamide
CID 110008383
2-(2,4-dichlorophenoxy)-N-(1-methylbenzimidazol-2-yl)acetamide
CID 35280310
5-chloro-N-(1-ethylbenzimidazol-2-yl)-2-methoxybenzamide
CID 27898030
N-(2-methoxyphenyl)-1-methyl-2-(trifluoromethyl)benzimidazole-5-carboxamide
CID 75422212
4-methoxy-N-[(3S)-3-[(R)-methylsulfinyl]butyl]-3-pyridin-2-ylbenzamide
CID 97086951

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide?
The IUPAC name of N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide (CID 99718321) is N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide.
What is the SMILES notation for N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide?
The canonical SMILES for N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide is COc1ccc(C(=O)Nc2nc3cc(Cl)ccc3n2C)cc1-c1ccccn1.
What is the InChIKey of N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide?
The InChIKey is ZEXMVQXEMMMDFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN4O2/c1-26-18-8-7-14(22)12-17(18)24-21(26)25-20(27)13-6-9-19(28-2)15(11-13)16-5-3-4-10-23-16/h3-12H,1-2H3,(H,24,25,27).
What are the key properties of N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide?
N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide has a molecular weight of 392.85 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-1-methylbenzimidazol-2-yl)-4-methoxy-3-pyridin-2-ylbenzamide is sourced from PubChem (CID 99718321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).