4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide

C12H13N3O2 — CID 103956818

IUPAC4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
SMILESCc1cc(C(=O)Nc2ccnn2C)ccc1O
InChIInChI=1S/C12H13N3O2/c1-8-7-9(3-4-10(8)16)12(17)14-11-5-6-13-15(11)2/h3-7,16H,1-2H3,(H,14,17)
InChIKeyILESWHVMDUYLMA-UHFFFAOYSA-N
MW231.25 g/mol
LogP1.69
Rot. Bonds2

About 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide

4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide (PubChem CID 103956818) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
PubChem CID103956818
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
SMILESCc1cc(C(=O)Nc2ccnn2C)ccc1O
InChIInChI=1S/C12H13N3O2/c1-8-7-9(3-4-10(8)16)12(17)14-11-5-6-13-15(11)2/h3-7,16H,1-2H3,(H,14,17)
InChIKeyILESWHVMDUYLMA-UHFFFAOYSA-N
XLogP1.69
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydrazinyl-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 63211576
3-methyl-N-(2-methylpyrazol-3-yl)-4-(propylamino)benzamide
CID 63214108
4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 113357521
N-(2-methylpyrazol-3-yl)pyridine-4-carboxamide
CID 110471287
4-bromo-3-chloro-N-(2-methylpyrazol-3-yl)benzamide
CID 81005079
3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
CID 110472464
4-(dimethylamino)-N-(2-methylpyrazol-3-yl)benzamide
CID 110473266
3-methyl-N-(2-methylpyrazol-3-yl)-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide
CID 112524831
N-(2-methylpyrazol-3-yl)-1H-indazole-6-carboxamide
CID 62905623
2-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 66675219
N-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-3-methylbenzamide
CID 107676575
N-(3,5-dichloro-2-hydroxyphenyl)-4-hydroxy-3-methylbenzamide
CID 103958263

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide?
The IUPAC name of 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide (CID 103956818) is 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide is Cc1cc(C(=O)Nc2ccnn2C)ccc1O.
What is the InChIKey of 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide?
The InChIKey is ILESWHVMDUYLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-8-7-9(3-4-10(8)16)12(17)14-11-5-6-13-15(11)2/h3-7,16H,1-2H3,(H,14,17).
What are the key properties of 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide?
4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide has a molecular weight of 231.25 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 103956818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).