N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide

C10H12N6O — CID 131960922

IUPACN-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2nc(C)nn2C)cn1
InChIInChI=1S/C10H12N6O/c1-6-4-12-8(5-11-6)9(17)14-10-13-7(2)15-16(10)3/h4-5H,1-3H3,(H,13,14,15,17)
InChIKeyGKRLFLBAHYSCBS-UHFFFAOYSA-N
MW232.25 g/mol
LogP0.47
Rot. Bonds2

About N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide

N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide (PubChem CID 131960922) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide
PubChem CID131960922
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC NameN-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2nc(C)nn2C)cn1
InChIInChI=1S/C10H12N6O/c1-6-4-12-8(5-11-6)9(17)14-10-13-7(2)15-16(10)3/h4-5H,1-3H3,(H,13,14,15,17)
InChIKeyGKRLFLBAHYSCBS-UHFFFAOYSA-N
XLogP0.47
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-N-(2-methyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)pyrazine-2-carboxamide
CID 134710374
N-(3-ethyl-1-methylpyrazol-4-yl)-5-methylpyrazine-2-carboxamide
CID 138992151
N-(1-tert-butylbenzimidazol-2-yl)-5-methylpyrazine-2-carboxamide
CID 51093633
N-[4,6-dimethyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-5-methylpyrazine-2-carboxamide
CID 122357284
N-(2,6-diethylphenyl)-5-methylpyrazine-2-carboxamide
CID 17441034
N-(3-hydroxy-2-pyridinyl)-5-methylpyrazine-2-carboxamide
CID 135950880
N-(4-iodophenyl)-5-methylpyrazine-2-carboxamide
CID 2388228
N-[4-(diethylcarbamoyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 8503925
5-bromo-N-(2,5-dimethylpyrazol-3-yl)pyrazine-2-carboxamide
CID 112524897
N-(2,6-difluorophenyl)-5-methylpyrazine-2-carboxamide
CID 51158953
N-(5-bromopyrazin-2-yl)-5-methylpyrazine-2-carboxamide
CID 115650022
5-methyl-3-[(5-methylpyrazine-2-carbonyl)amino]-1H-pyrrole-2-carboxylic acid
CID 113483074

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide (CID 131960922) is N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide is Cc1cnc(C(=O)Nc2nc(C)nn2C)cn1.
What is the InChIKey of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide?
The InChIKey is GKRLFLBAHYSCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-6-4-12-8(5-11-6)9(17)14-10-13-7(2)15-16(10)3/h4-5H,1-3H3,(H,13,14,15,17).
What are the key properties of N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide?
N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide has a molecular weight of 232.25 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethyl-1,2,4-triazol-3-yl)-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 131960922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).