2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide

C25H21N5O — CID 166230073

IUPAC2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide
SMILESCc1c(NC(=O)C(c2ccccc2)n2cnc3ccccc32)cnn1-c1ccccc1
InChIInChI=1S/C25H21N5O/c1-18-22(16-27-30(18)20-12-6-3-7-13-20)28-25(31)24(19-10-4-2-5-11-19)29-17-26-21-14-8-9-15-23(21)29/h2-17,24H,1H3,(H,28,31)
InChIKeyGDHQEPZDLXNOCW-UHFFFAOYSA-N
MW407.48 g/mol
LogP4.76
Rot. Bonds5

About 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide

2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide (PubChem CID 166230073) has the molecular formula C25H21N5O and a molecular weight of 407.48 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide
PubChem CID166230073
Molecular FormulaC25H21N5O
Molecular Weight407.48 g/mol
Exact Mass407.17
IUPAC Name2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide
SMILESCc1c(NC(=O)C(c2ccccc2)n2cnc3ccccc32)cnn1-c1ccccc1
InChIInChI=1S/C25H21N5O/c1-18-22(16-27-30(18)20-12-6-3-7-13-20)28-25(31)24(19-10-4-2-5-11-19)29-17-26-21-14-8-9-15-23(21)29/h2-17,24H,1H3,(H,28,31)
InChIKeyGDHQEPZDLXNOCW-UHFFFAOYSA-N
XLogP4.76
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.48
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(benzimidazol-1-yl)-N-[5-(difluoromethyl)-1-methylpyrazol-4-yl]-2-phenylacetamide
CID 154858240
N-benzhydryl-2-(benzimidazol-1-yl)propanamide
CID 112781098
N-(5-methyl-1-phenylpyrazol-4-yl)pyridine-4-carboxamide
CID 11242907
3-[2-(benzimidazol-1-yl)propanoylamino]-N,2-dimethylbenzamide
CID 46434262
methyl 2-(5-aminobenzimidazol-1-yl)-2-phenylacetate
CID 62508537
(2S)-2-(benzimidazol-1-yl)-N-(4-oxo-1H-pyridin-3-yl)propanamide
CID 94151702
3-(benzimidazol-1-yl)butanoic acid
CID 6486725
(2R)-2-(benzimidazol-1-yl)-N-[(S)-phenyl(thiophen-2-yl)methyl]propanamide
CID 39059871
1-[(5-methyl-1-phenylpyrazol-4-yl)carbamoyl]piperidine-4-carboxylic acid
CID 122087339
ethyl (Z)-3-[(5-methyl-1-phenylpyrazol-4-yl)amino]but-2-enoate
CID 70394620
N-[2-[2-(benzimidazol-1-yl)propanoylamino]ethyl]benzamide
CID 42959454
3-(benzimidazol-1-yl)-2-methylbutanoic acid
CID 79391700

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide (CID 166230073) is 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide is Cc1c(NC(=O)C(c2ccccc2)n2cnc3ccccc32)cnn1-c1ccccc1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide?
The InChIKey is GDHQEPZDLXNOCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O/c1-18-22(16-27-30(18)20-12-6-3-7-13-20)28-25(31)24(19-10-4-2-5-11-19)29-17-26-21-14-8-9-15-23(21)29/h2-17,24H,1H3,(H,28,31).
What are the key properties of 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide?
2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide has a molecular weight of 407.48 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-(5-methyl-1-phenylpyrazol-4-yl)-2-phenylacetamide is sourced from PubChem (CID 166230073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).