6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C14H14N4 — CID 83964997

IUPAC6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCc1cccc(-c2nc3c(N)cc(C)cn3n2)c1
InChIInChI=1S/C14H14N4/c1-9-4-3-5-11(6-9)13-16-14-12(15)7-10(2)8-18(14)17-13/h3-8H,15H2,1-2H3
InChIKeyVWTNXBHXRVBYHE-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.60
Rot. Bonds1

About 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 83964997) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID83964997
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCc1cccc(-c2nc3c(N)cc(C)cn3n2)c1
InChIInChI=1S/C14H14N4/c1-9-4-3-5-11(6-9)13-16-14-12(15)7-10(2)8-18(14)17-13/h3-8H,15H2,1-2H3
InChIKeyVWTNXBHXRVBYHE-UHFFFAOYSA-N
XLogP2.60
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 83964997) is 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is Cc1cccc(-c2nc3c(N)cc(C)cn3n2)c1.
What is the InChIKey of 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is VWTNXBHXRVBYHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-4-3-5-11(6-9)13-16-14-12(15)7-10(2)8-18(14)17-13/h3-8H,15H2,1-2H3.
What are the key properties of 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 238.29 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 83964997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).