2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine

C14H13N5O — CID 95931444

IUPAC2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine
SMILESCOc1cncc(-c2nc(C)n(-c3ccccc3)n2)n1
InChIInChI=1S/C14H13N5O/c1-10-16-14(12-8-15-9-13(17-12)20-2)18-19(10)11-6-4-3-5-7-11/h3-9H,1-2H3
InChIKeyROOFMISNHOHVMJ-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.04
Rot. Bonds3

About 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine

2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine (PubChem CID 95931444) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine.

Molecular Properties

Compound Name2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine
PubChem CID95931444
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine
SMILESCOc1cncc(-c2nc(C)n(-c3ccccc3)n2)n1
InChIInChI=1S/C14H13N5O/c1-10-16-14(12-8-15-9-13(17-12)20-2)18-19(10)11-6-4-3-5-7-11/h3-9H,1-2H3
InChIKeyROOFMISNHOHVMJ-UHFFFAOYSA-N
XLogP2.04
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-6-(2-methoxyphenyl)pyrazine
CID 135043154
3-chloro-5-methyl-1-phenyl-1,2,4-triazole
CID 30032671
2-methoxy-6-[3-(6-methoxypyrazin-2-yl)-1H-1,2,4-triazol-5-yl]pyrazine
CID 71593361
2-(6-methoxypyrazin-2-yl)-5-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
CID 169499284
6-methoxy-2-phenylpyridazin-3-one
CID 6456935
6-methoxy-1,3-diphenyl-1,2,4-benzotriazin-7-one
CID 53388862
cyclopenta-1,3-diene;2-cyclopenta-1,3-dien-1-yl-6-methoxypyrazine;iron(2+)
CID 162787673
2-(2,3-dichlorophenyl)-6-methoxypyrazine
CID 160525380
1-(2,6-dimethylphenyl)-5-methyl-3-phenyl-1,2,4-triazole
CID 140601898
5-methyl-1-(2-methylphenyl)-3-phenyl-1,2,4-triazole
CID 71073412
N,N-diethyl-2-[(5-methyl-1-phenyl-1,2,4-triazol-3-yl)oxy]ethanamine
CID 24951659
5-methyl-1-(2,3,4,5,6-pentafluorophenyl)-3-phenyl-1,2,4-triazole
CID 24764267

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine?
The IUPAC name of 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine (CID 95931444) is 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine.
What is the SMILES notation for 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine?
The canonical SMILES for 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine is COc1cncc(-c2nc(C)n(-c3ccccc3)n2)n1.
What is the InChIKey of 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine?
The InChIKey is ROOFMISNHOHVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-10-16-14(12-8-15-9-13(17-12)20-2)18-19(10)11-6-4-3-5-7-11/h3-9H,1-2H3.
What are the key properties of 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine?
2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine has a molecular weight of 267.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(5-methyl-1-phenyl-1,2,4-triazol-3-yl)pyrazine is sourced from PubChem (CID 95931444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).