2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride

C21H18ClN3O — CID 66899593

IUPAC2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride
SMILESCl.O=C(Cn1cnc2ccccc21)Nc1cccc(-c2ccccc2)c1
InChIInChI=1S/C21H17N3O.ClH/c25-21(14-24-15-22-19-11-4-5-12-20(19)24)23-18-10-6-9-17(13-18)16-7-2-1-3-8-16;/h1-13,15H,14H2,(H,23,25);1H
InChIKeyUKJYRNFUAVNZPQ-UHFFFAOYSA-N
MW363.85 g/mol
LogP4.76
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride

2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride (PubChem CID 66899593) has the molecular formula C21H18ClN3O and a molecular weight of 363.85 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride
PubChem CID66899593
Molecular FormulaC21H18ClN3O
Molecular Weight363.85 g/mol
Exact Mass363.11
IUPAC Name2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride
SMILESCl.O=C(Cn1cnc2ccccc21)Nc1cccc(-c2ccccc2)c1
InChIInChI=1S/C21H17N3O.ClH/c25-21(14-24-15-22-19-11-4-5-12-20(19)24)23-18-10-6-9-17(13-18)16-7-2-1-3-8-16;/h1-13,15H,14H2,(H,23,25);1H
InChIKeyUKJYRNFUAVNZPQ-UHFFFAOYSA-N
XLogP4.76
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzimidazol-1-yl)-N-[3-(methylamino)phenyl]acetamide
CID 70918719
2-(benzimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 744841
2-(benzimidazol-1-yl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 121090100
2-(benzimidazol-1-yl)-N-(3,4-difluorophenyl)acetamide
CID 3578169
2-(benzimidazol-1-yl)-N-(4-chloro-3-methylphenyl)acetamide
CID 6459558
4-[[2-(benzimidazol-1-yl)acetyl]amino]benzoate
CID 6969911
2-(benzimidazol-1-yl)-N-[3-[5-(trifluoromethyl)-2-pyridinyl]phenyl]acetamide;2-(benzimidazol-1-yl)-N-[3-[6-(trifluoromethyl)-2-pyridinyl]phenyl]acetamide
CID 87835884
N-[3-(benzimidazol-1-ylmethyl)phenyl]-2-benzylsulfanylacetamide
CID 166200570
2-(benzimidazol-1-yl)-N-[(Z)-(4-phenylphenyl)methylideneamino]acetamide
CID 9121187
2-(benzimidazol-1-yl)-N-(1,3-dihydroxypropan-2-yl)acetamide
CID 65315452
2-(5,6-dimethylbenzimidazol-1-yl)-N-(3-methylphenyl)acetamide
CID 17028500
(2S)-2-[[2-(benzimidazol-1-yl)acetyl]amino]-N-methylbutanediamide
CID 58709539

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride (CID 66899593) is 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride is Cl.O=C(Cn1cnc2ccccc21)Nc1cccc(-c2ccccc2)c1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride?
The InChIKey is UKJYRNFUAVNZPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O.ClH/c25-21(14-24-15-22-19-11-4-5-12-20(19)24)23-18-10-6-9-17(13-18)16-7-2-1-3-8-16;/h1-13,15H,14H2,(H,23,25);1H.
What are the key properties of 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride?
2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride has a molecular weight of 363.85 g/mol, XLogP of 4.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 66899593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).