4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide

C11H12N4O2 — CID 113357521

IUPAC4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
SMILESCc1cc(C(=O)Nc2ncnn2C)ccc1O
InChIInChI=1S/C11H12N4O2/c1-7-5-8(3-4-9(7)16)10(17)14-11-12-6-13-15(11)2/h3-6,16H,1-2H3,(H,12,13,14,17)
InChIKeyTUJCIJSDMKSCRX-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.08
Rot. Bonds2

About 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide

4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide (PubChem CID 113357521) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide.

Molecular Properties

Compound Name4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
PubChem CID113357521
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
SMILESCc1cc(C(=O)Nc2ncnn2C)ccc1O
InChIInChI=1S/C11H12N4O2/c1-7-5-8(3-4-9(7)16)10(17)14-11-12-6-13-15(11)2/h3-6,16H,1-2H3,(H,12,13,14,17)
InChIKeyTUJCIJSDMKSCRX-UHFFFAOYSA-N
XLogP1.08
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 80710118
3-hydroxy-4-methoxy-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 80716625
4-hydroxy-3-methyl-N-(2-methylpyrazol-3-yl)benzamide
CID 103956818
4-bromo-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 80709266
N-(2-methyl-1,2,4-triazol-3-yl)-2-oxo-1H-pyridine-4-carboxamide
CID 103800959
3-bromo-4-fluoro-N-(2-methyl-1,2,4-triazol-3-yl)benzamide
CID 103769476
N-(2-methyl-1,2,4-triazol-3-yl)-1H-indole-6-carboxamide
CID 80709605
2-amino-6-chloro-N-(2-methyl-1,2,4-triazol-3-yl)pyridine-4-carboxamide
CID 80716626
N-(2-methyl-1,2,4-triazol-3-yl)acetamide
CID 119096873
N-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-3-methylbenzamide
CID 107676575
4-hydroxy-3-methyl-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 113357499
4-hydroxy-3-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 113357489

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide?
The IUPAC name of 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide (CID 113357521) is 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide.
What is the SMILES notation for 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide?
The canonical SMILES for 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide is Cc1cc(C(=O)Nc2ncnn2C)ccc1O.
What is the InChIKey of 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide?
The InChIKey is TUJCIJSDMKSCRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-7-5-8(3-4-9(7)16)10(17)14-11-12-6-13-15(11)2/h3-6,16H,1-2H3,(H,12,13,14,17).
What are the key properties of 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide?
4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide has a molecular weight of 232.24 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-methyl-N-(2-methyl-1,2,4-triazol-3-yl)benzamide is sourced from PubChem (CID 113357521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).