N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide

C21H17N3O2 — CID 46692672

IUPACN-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C21H17N3O2/c1-26-20-9-5-2-6-17(20)21(25)23-15-10-12-16(13-11-15)24-14-22-18-7-3-4-8-19(18)24/h2-14H,1H3,(H,23,25)
InChIKeyYIWAWQVIOKOWHT-UHFFFAOYSA-N
MW343.39 g/mol
LogP4.29
Rot. Bonds4

About N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide

N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide (PubChem CID 46692672) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide
PubChem CID46692672
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(-n2cnc3ccccc32)cc1
InChIInChI=1S/C21H17N3O2/c1-26-20-9-5-2-6-17(20)21(25)23-15-10-12-16(13-11-15)24-14-22-18-7-3-4-8-19(18)24/h2-14H,1H3,(H,23,25)
InChIKeyYIWAWQVIOKOWHT-UHFFFAOYSA-N
XLogP4.29
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(benzimidazol-1-yl)phenyl]-2-bromobenzamide
CID 46688452
4-(benzimidazol-1-yl)-N-(3,4-dimethoxyphenyl)benzamide
CID 17434692
methyl 2-[2-[[4-(benzimidazol-1-yl)phenyl]carbamoyl]phenyl]sulfanylpropanoate
CID 60528401
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
(2S)-2-amino-N-[4-(benzimidazol-1-yl)phenyl]-3,3-dimethylbutanamide
CID 119834362
2-methoxy-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 960710
N-[4-(benzimidazol-1-yl)phenyl]-5-(methoxymethyl)furan-2-carboxamide
CID 86912094
N-[4-(benzimidazol-1-yl)phenyl]-2-chloro-5-methylsulfonylbenzamide
CID 78803455
(Z)-N-[4-(benzimidazol-1-yl)phenyl]-2-methylpent-2-enamide
CID 60553883
N-[4-(benzimidazol-1-yl)phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 17487112
N-[2-[4-(benzimidazol-1-yl)anilino]-2-oxoethyl]-4-methylbenzamide
CID 24600085
N-[4-(1,3-dioxoisoindol-2-yl)phenyl]-2-methoxybenzamide
CID 110352322

Frequently Asked Questions

What is the IUPAC name of N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide?
The IUPAC name of N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide (CID 46692672) is N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide?
The canonical SMILES for N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(-n2cnc3ccccc32)cc1.
What is the InChIKey of N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide?
The InChIKey is YIWAWQVIOKOWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c1-26-20-9-5-2-6-17(20)21(25)23-15-10-12-16(13-11-15)24-14-22-18-7-3-4-8-19(18)24/h2-14H,1H3,(H,23,25).
What are the key properties of N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide?
N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide has a molecular weight of 343.39 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzimidazol-1-yl)phenyl]-2-methoxybenzamide is sourced from PubChem (CID 46692672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).