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

C10H10N4O3 — CID 6481026

IUPAC2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide
SMILESCOc1ccc(C(=O)Nn2cncn2)c(O)c1
InChIInChI=1S/C10H10N4O3/c1-17-7-2-3-8(9(15)4-7)10(16)13-14-6-11-5-12-14/h2-6,15H,1H3,(H,13,16)
InChIKeyASLSDPIJVSFAES-UHFFFAOYSA-N
MW234.22 g/mol
LogP0.38
Rot. Bonds3

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

2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide (PubChem CID 6481026) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide
PubChem CID6481026
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Name2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide
SMILESCOc1ccc(C(=O)Nn2cncn2)c(O)c1
InChIInChI=1S/C10H10N4O3/c1-17-7-2-3-8(9(15)4-7)10(16)13-14-6-11-5-12-14/h2-6,15H,1H3,(H,13,16)
InChIKeyASLSDPIJVSFAES-UHFFFAOYSA-N
XLogP0.38
TPSA89.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 23249025
2-hydroxy-N-[1-(4-imidazol-1-ylphenyl)ethyl]-4-methoxybenzamide
CID 43003578
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
2-hydroxy-4-methoxy-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79351166
N-(5-bromo-6-methyl-2-pyridinyl)-2-hydroxy-4-methoxybenzamide
CID 79048960
2-hydroxy-4-methoxy-N-(3-methoxypropyl)benzamide
CID 43090058
2-hydroxy-N-(3-hydroxypropyl)-4-methoxybenzamide
CID 43390117
2-hydroxy-4-methoxy-N-(2-methylprop-2-enyl)benzamide
CID 114617408
2,4-dimethoxy-N-(1,2,4-triazol-4-yl)benzamide
CID 936109
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-2-hydroxy-4-methoxybenzamide
CID 115595332
2-hydroxy-4-methoxy-N-(4-methylsulfonylphenyl)benzamide
CID 155988762
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-hydroxy-4-methoxybenzamide
CID 79524203

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide?
The IUPAC name of 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide (CID 6481026) is 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide.
What is the SMILES notation for 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide?
The canonical SMILES for 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide is COc1ccc(C(=O)Nn2cncn2)c(O)c1.
What is the InChIKey of 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide?
The InChIKey is ASLSDPIJVSFAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c1-17-7-2-3-8(9(15)4-7)10(16)13-14-6-11-5-12-14/h2-6,15H,1H3,(H,13,16).
What are the key properties of 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide?
2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide has a molecular weight of 234.22 g/mol, XLogP of 0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4-methoxy-N-(1,2,4-triazol-1-yl)benzamide is sourced from PubChem (CID 6481026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).