N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

C14H13N5O2 — CID 16585086

IUPACN-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc2ncnn2c1C
InChIInChI=1S/C14H13N5O2/c1-9-10(7-15-14-16-8-17-19(9)14)13(20)18-11-5-3-4-6-12(11)21-2/h3-8H,1-2H3,(H,18,20)
InChIKeyYMDJXQFPRPSOQV-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.69
Rot. Bonds3

About N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 16585086) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID16585086
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC NameN-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc2ncnn2c1C
InChIInChI=1S/C14H13N5O2/c1-9-10(7-15-14-16-8-17-19(9)14)13(20)18-11-5-3-4-6-12(11)21-2/h3-8H,1-2H3,(H,18,20)
InChIKeyYMDJXQFPRPSOQV-UHFFFAOYSA-N
XLogP1.69
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 66505339
N-(2-methoxyphenyl)-3-(4-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 43865296
2-bromo-N-(2-methoxyphenyl)benzamide
CID 676344
N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide
CID 66499445
N-(2-methoxyphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 66504208
N-(2-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18148000
2-[(2-methoxyphenyl)carbamoyl]benzoic acid
CID 762850
2-N,5-N-bis(2-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1369664
4-chloro-N-(2-methoxyphenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 7423439
4-hydrazinyl-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 81256164
(2E)-N-(2-methoxyphenyl)-2-(5-oxo-4H-imidazo[1,2-b][1,2,4]triazol-6-ylidene)acetamide
CID 135727170
5-bromo-2-chloro-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 62001368

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (CID 16585086) is N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is COc1ccccc1NC(=O)c1cnc2ncnn2c1C.
What is the InChIKey of N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is YMDJXQFPRPSOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c1-9-10(7-15-14-16-8-17-19(9)14)13(20)18-11-5-3-4-6-12(11)21-2/h3-8H,1-2H3,(H,18,20).
What are the key properties of N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 16585086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).