3-fluoro-N-(2-methylpyrazol-3-yl)benzamide

C11H10FN3O — CID 110472464

IUPAC3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
SMILESCn1nccc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C11H10FN3O/c1-15-10(5-6-13-15)14-11(16)8-3-2-4-9(12)7-8/h2-7H,1H3,(H,14,16)
InChIKeyLXMZMBCLGURMDO-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.81
Rot. Bonds2

About 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide

3-fluoro-N-(2-methylpyrazol-3-yl)benzamide (PubChem CID 110472464) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
PubChem CID110472464
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
SMILESCn1nccc1NC(=O)c1cccc(F)c1
InChIInChI=1S/C11H10FN3O/c1-15-10(5-6-13-15)14-11(16)8-3-2-4-9(12)7-8/h2-7H,1H3,(H,14,16)
InChIKeyLXMZMBCLGURMDO-UHFFFAOYSA-N
XLogP1.81
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-fluorophenyl)methyl]-N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110111970
N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 103956818
5-[(3-fluorobenzoyl)amino]-1-methylpyrazole-4-carboxylic acid
CID 110483243
4-bromo-3-chloro-N-(2-methylpyrazol-3-yl)benzamide
CID 81005079
N-(2-methylpyrazol-3-yl)-1H-indazole-6-carboxamide
CID 62905623
2-(4-fluorophenyl)-N-methyl-5-[3-[(2-methylpyrazol-3-yl)carbamoyl]phenyl]-1-benzofuran-3-carboxamide
CID 59275721
4-hydrazinyl-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 63211576
3-fluoro-N-(1-methylindazol-6-yl)benzamide
CID 110462740
4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
CID 110473266
N-[2-[1-[(4-ethylphenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-3-fluorobenzamide
CID 24791290
3-methyl-N-(2-methylpyrazol-3-yl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 112524831

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide?
The IUPAC name of 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide (CID 110472464) is 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide is Cn1nccc1NC(=O)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide?
The InChIKey is LXMZMBCLGURMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-15-10(5-6-13-15)14-11(16)8-3-2-4-9(12)7-8/h2-7H,1H3,(H,14,16).
What are the key properties of 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide?
3-fluoro-N-(2-methylpyrazol-3-yl)benzamide has a molecular weight of 219.22 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 110472464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).