3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine

C12H10N4 — CID 13199874

IUPAC3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCc1nnc2cnc(-c3ccccc3)cn12
InChIInChI=1S/C12H10N4/c1-9-14-15-12-7-13-11(8-16(9)12)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyPTGIYHJNEWXRKH-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.10
Rot. Bonds1

About 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine

3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 13199874) has the molecular formula C12H10N4 and a molecular weight of 210.24 g/mol. Its IUPAC name is 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID13199874
Molecular FormulaC12H10N4
Molecular Weight210.24 g/mol
Exact Mass210.09
IUPAC Name3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCc1nnc2cnc(-c3ccccc3)cn12
InChIInChI=1S/C12H10N4/c1-9-14-15-12-7-13-11(8-16(9)12)10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyPTGIYHJNEWXRKH-UHFFFAOYSA-N
XLogP2.10
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(6-phenyl-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)benzoic acid
CID 156503118
6-bromo-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine
CID 130756639
6-[5-fluoro-6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine
CID 167615181
3-methyl-6-propan-2-yl-[1,2,4]triazolo[4,3-a]pyrazine
CID 163821411
5-methyl-2-phenylimidazo[1,2-a]pyridine
CID 735395
6-phenyl-3-thiophen-3-ylimidazo[1,2-a]pyrazine
CID 126673283
4-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazin-6-yl]phenol
CID 134555720
6-(4-ethoxyphenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 134555560
6-(1-benzylpyrazol-4-yl)-3-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 143183374
ethane;6-(4-fluorophenyl)-3-methylimidazo[1,2-a]pyrazine
CID 143706949
ethane;3-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 91210925
6-[4-(methoxymethyl)phenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 134555591

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine (CID 13199874) is 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine is Cc1nnc2cnc(-c3ccccc3)cn12.
What is the InChIKey of 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is PTGIYHJNEWXRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4/c1-9-14-15-12-7-13-11(8-16(9)12)10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine?
3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 210.24 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-phenyl-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 13199874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).