2-methoxy-N-(1-methyltriazol-4-yl)benzamide

C11H12N4O2 — CID 112535372

IUPAC2-methoxy-N-(1-methyltriazol-4-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1cn(C)nn1
InChIInChI=1S/C11H12N4O2/c1-15-7-10(13-14-15)12-11(16)8-5-3-4-6-9(8)17-2/h3-7H,1-2H3,(H,12,16)
InChIKeyYGWMAEMDESLFFR-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.08
Rot. Bonds3

About 2-methoxy-N-(1-methyltriazol-4-yl)benzamide

2-methoxy-N-(1-methyltriazol-4-yl)benzamide (PubChem CID 112535372) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 2-methoxy-N-(1-methyltriazol-4-yl)benzamide.

Molecular Properties

Compound Name2-methoxy-N-(1-methyltriazol-4-yl)benzamide
PubChem CID112535372
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name2-methoxy-N-(1-methyltriazol-4-yl)benzamide
SMILESCOc1ccccc1C(=O)Nc1cn(C)nn1
InChIInChI=1S/C11H12N4O2/c1-15-7-10(13-14-15)12-11(16)8-5-3-4-6-9(8)17-2/h3-7H,1-2H3,(H,12,16)
InChIKeyYGWMAEMDESLFFR-UHFFFAOYSA-N
XLogP1.08
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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2-methoxy-N-[6-(2-propan-2-ylanilino)pyridazin-3-yl]benzamide
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2-methoxy-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
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N-[6-(3,5-dichloroanilino)pyridazin-3-yl]-2-methoxybenzamide
CID 113050853
N-[6-[2-(4-chlorophenyl)ethylamino]pyridazin-3-yl]-2-methoxybenzamide
CID 113043306
2-methoxy-N-[6-(pentylamino)pyridazin-3-yl]benzamide
CID 113044650
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
N-(2-acetamidophenyl)-2-methoxybenzamide
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2-methoxybenzohydrazide
CID 24051
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CID 113048928

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-methyltriazol-4-yl)benzamide?
The IUPAC name of 2-methoxy-N-(1-methyltriazol-4-yl)benzamide (CID 112535372) is 2-methoxy-N-(1-methyltriazol-4-yl)benzamide.
What is the SMILES notation for 2-methoxy-N-(1-methyltriazol-4-yl)benzamide?
The canonical SMILES for 2-methoxy-N-(1-methyltriazol-4-yl)benzamide is COc1ccccc1C(=O)Nc1cn(C)nn1.
What is the InChIKey of 2-methoxy-N-(1-methyltriazol-4-yl)benzamide?
The InChIKey is YGWMAEMDESLFFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-15-7-10(13-14-15)12-11(16)8-5-3-4-6-9(8)17-2/h3-7H,1-2H3,(H,12,16).
What are the key properties of 2-methoxy-N-(1-methyltriazol-4-yl)benzamide?
2-methoxy-N-(1-methyltriazol-4-yl)benzamide has a molecular weight of 232.24 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-methyltriazol-4-yl)benzamide is sourced from PubChem (CID 112535372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).