6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine

C7H8N4 — CID 590435

IUPAC6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
SMILESCc1ccc2nnc(N)n2c1
InChIInChI=1S/C7H8N4/c1-5-2-3-6-9-10-7(8)11(6)4-5/h2-4H,1H3,(H2,8,10)
InChIKeyPKVCCRUNBRFZNP-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.62
Rot. Bonds

About 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine

6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine (PubChem CID 590435) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine.

Molecular Properties

Compound Name6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
PubChem CID590435
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
SMILESCc1ccc2nnc(N)n2c1
InChIInChI=1S/C7H8N4/c1-5-2-3-6-9-10-7(8)11(6)4-5/h2-4H,1H3,(H2,8,10)
InChIKeyPKVCCRUNBRFZNP-UHFFFAOYSA-N
XLogP0.62
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine?
The IUPAC name of 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine (CID 590435) is 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine.
What is the SMILES notation for 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine?
The canonical SMILES for 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine is Cc1ccc2nnc(N)n2c1.
What is the InChIKey of 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine?
The InChIKey is PKVCCRUNBRFZNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-5-2-3-6-9-10-7(8)11(6)4-5/h2-4H,1H3,(H2,8,10).
What are the key properties of 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine?
6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine has a molecular weight of 148.17 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine is sourced from PubChem (CID 590435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).