N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide

C11H12N4O2 — CID 110691757

IUPACN-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
SMILESCOc1ccccc1NC(=O)c1n[nH]nc1C
InChIInChI=1S/C11H12N4O2/c1-7-10(14-15-13-7)11(16)12-8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,12,16)(H,13,14,15)
InChIKeySWWMPNOGNXNVDH-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.37
Rot. Bonds3

About N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide

N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide (PubChem CID 110691757) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
PubChem CID110691757
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC NameN-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
SMILESCOc1ccccc1NC(=O)c1n[nH]nc1C
InChIInChI=1S/C11H12N4O2/c1-7-10(14-15-13-7)11(16)12-8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,12,16)(H,13,14,15)
InChIKeySWWMPNOGNXNVDH-UHFFFAOYSA-N
XLogP1.37
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
CID 110691766
6,7-difluoro-N-(2-methoxyphenyl)-3-methylquinoxaline-2-carboxamide
CID 23963431
3-hydroxy-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 54860878
N-(2,6-dimethylphenyl)-5-methyl-2H-triazole-4-carboxamide
CID 110691729
N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide
CID 66499445
6-[4-[1-(dimethylamino)ethenyl]phenyl]-N-(2-methoxyphenyl)-3-methylpyrazine-2-carboxamide
CID 160691090
N-(2-methoxyphenyl)-2-oxo-1H-quinazoline-4-carboxamide
CID 110702587
N-(2-methoxyphenyl)-4-(2H-tetrazol-5-yl)benzamide
CID 23541019
N-(2-methoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 110650217
6-anilino-N-(2-methoxyphenyl)-3-methylpyrazine-2-carboxamide;molecular hydrogen
CID 158660469
N-(2-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18148000
N-(2-methoxyphenyl)-1-methylindazole-3-carboxamide
CID 110859879

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide (CID 110691757) is N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide is COc1ccccc1NC(=O)c1n[nH]nc1C.
What is the InChIKey of N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide?
The InChIKey is SWWMPNOGNXNVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c1-7-10(14-15-13-7)11(16)12-8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H,12,16)(H,13,14,15).
What are the key properties of N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide?
N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide has a molecular weight of 232.24 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide is sourced from PubChem (CID 110691757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).