2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide

C19H17N5O — CID 16678852

IUPAC2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide
SMILESCc1cccc(-n2ccc(NC(=O)Cn3cnc4ccccc43)n2)c1
InChIInChI=1S/C19H17N5O/c1-14-5-4-6-15(11-14)24-10-9-18(22-24)21-19(25)12-23-13-20-16-7-2-3-8-17(16)23/h2-11,13H,12H2,1H3,(H,21,22,25)
InChIKeyYLUOUVUDTXXGNH-UHFFFAOYSA-N
MW331.38 g/mol
LogP3.17
Rot. Bonds4

About 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide

2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide (PubChem CID 16678852) has the molecular formula C19H17N5O and a molecular weight of 331.38 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide
PubChem CID16678852
Molecular FormulaC19H17N5O
Molecular Weight331.38 g/mol
Exact Mass331.14
IUPAC Name2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide
SMILESCc1cccc(-n2ccc(NC(=O)Cn3cnc4ccccc43)n2)c1
InChIInChI=1S/C19H17N5O/c1-14-5-4-6-15(11-14)24-10-9-18(22-24)21-19(25)12-23-13-20-16-7-2-3-8-17(16)23/h2-11,13H,12H2,1H3,(H,21,22,25)
InChIKeyYLUOUVUDTXXGNH-UHFFFAOYSA-N
XLogP3.17
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-4-methylphenyl)-2-(benzimidazol-1-yl)acetamide
CID 43376196
2-(benzimidazol-1-yl)-N-[3-(methylamino)phenyl]acetamide
CID 70918719
3-(3-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55547813
1-[[2-(benzimidazol-1-yl)acetyl]amino]-3-(2,5-dimethylphenyl)thiourea
CID 8659503
N-methyl-1-(3-methylphenyl)pyrazol-3-amine
CID 83876804
2-(benzimidazol-1-yl)-N-(4-chloro-3-methylphenyl)acetamide
CID 6459558
2-(benzimidazol-1-yl)-N-[4-[[6-[(4-methyl-2-pyridinyl)amino]pyrimidin-4-yl]amino]phenyl]acetamide
CID 122316227
2-(benzimidazol-1-yl)-N-(3-phenylphenyl)acetamide;hydrochloride
CID 66899593
2-(5,6-dimethylbenzimidazol-1-yl)-N-(3-methylphenyl)acetamide
CID 17028500
2-(benzimidazol-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)acetamide
CID 115621135
2-(6-bromo-4-oxoquinazolin-3-yl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 55718262
2-(benzimidazol-1-yl)-N-(3,4-difluorophenyl)acetamide
CID 3578169

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide (CID 16678852) is 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide is Cc1cccc(-n2ccc(NC(=O)Cn3cnc4ccccc43)n2)c1.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide?
The InChIKey is YLUOUVUDTXXGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O/c1-14-5-4-6-15(11-14)24-10-9-18(22-24)21-19(25)12-23-13-20-16-7-2-3-8-17(16)23/h2-11,13H,12H2,1H3,(H,21,22,25).
What are the key properties of 2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide?
2-(benzimidazol-1-yl)-N-[1-(3-methylphenyl)pyrazol-3-yl]acetamide has a molecular weight of 331.38 g/mol, XLogP of 3.17, 4 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-[1-(3-methylphenyl)pyrazol-3-yl]acetamide is sourced from PubChem (CID 16678852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).