4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide

C19H16FN5O — CID 23959240

IUPAC4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide
SMILESCc1cc(NC(=O)c2ccc(F)cc2)n(-c2nc3ccccc3n2C)n1
InChIInChI=1S/C19H16FN5O/c1-12-11-17(22-18(26)13-7-9-14(20)10-8-13)25(23-12)19-21-15-5-3-4-6-16(15)24(19)2/h3-11H,1-2H3,(H,22,26)
InChIKeyAHYZUNVUFAODTG-UHFFFAOYSA-N
MW349.37 g/mol
LogP3.46
Rot. Bonds3

About 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide

4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide (PubChem CID 23959240) has the molecular formula C19H16FN5O and a molecular weight of 349.37 g/mol. Its IUPAC name is 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide
PubChem CID23959240
Molecular FormulaC19H16FN5O
Molecular Weight349.37 g/mol
Exact Mass349.13
IUPAC Name4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide
SMILESCc1cc(NC(=O)c2ccc(F)cc2)n(-c2nc3ccccc3n2C)n1
InChIInChI=1S/C19H16FN5O/c1-12-11-17(22-18(26)13-7-9-14(20)10-8-13)25(23-12)19-21-15-5-3-4-6-16(15)24(19)2/h3-11H,1-2H3,(H,22,26)
InChIKeyAHYZUNVUFAODTG-UHFFFAOYSA-N
XLogP3.46
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-[2-(1-ethylbenzimidazol-2-yl)-5-methylpyrazol-3-yl]benzamide
CID 23848230
N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]-5-methylpyrazol-3-yl]-4-methoxybenzamide
CID 23936504
N-[2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]-5-methylpyrazol-3-yl]-4-nitrobenzamide
CID 23861808
N-[2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]-5-methylpyrazol-3-yl]-2-fluorobenzamide
CID 3484830
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-3-methylbenzamide
CID 112805726
4-fluoro-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
CID 751122
N-[2-(1-benzylbenzimidazol-2-yl)-5-methylpyrazol-3-yl]-3,4,5-trimethoxybenzamide
CID 23761240
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-4-imidazol-1-ylbenzamide
CID 172890573
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-3-pyrrol-1-ylbenzamide
CID 112805877
4-(difluoromethoxy)-N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]benzamide
CID 112805768
N-[2-[1-[(2-chloro-6-fluorophenyl)methyl]benzimidazol-2-yl]-5-methylpyrazol-3-yl]-3,5-dinitrobenzamide
CID 23932625
N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-2,4-difluorobenzamide
CID 5042148

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide?
The IUPAC name of 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide (CID 23959240) is 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide.
What is the SMILES notation for 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide?
The canonical SMILES for 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide is Cc1cc(NC(=O)c2ccc(F)cc2)n(-c2nc3ccccc3n2C)n1.
What is the InChIKey of 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide?
The InChIKey is AHYZUNVUFAODTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O/c1-12-11-17(22-18(26)13-7-9-14(20)10-8-13)25(23-12)19-21-15-5-3-4-6-16(15)24(19)2/h3-11H,1-2H3,(H,22,26).
What are the key properties of 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide?
4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide has a molecular weight of 349.37 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[5-methyl-2-(1-methylbenzimidazol-2-yl)pyrazol-3-yl]benzamide is sourced from PubChem (CID 23959240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).