(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine

C8H10N4 — CID 55266770

IUPAC(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
SMILESCc1ccn2c(CN)nnc2c1
InChIInChI=1S/C8H10N4/c1-6-2-3-12-7(4-6)10-11-8(12)5-9/h2-4H,5,9H2,1H3
InChIKeyHMYNVTFOMRVVHM-UHFFFAOYSA-N
MW162.20 g/mol
LogP0.50
Rot. Bonds1

About (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine

(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine (PubChem CID 55266770) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
PubChem CID55266770
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
SMILESCc1ccn2c(CN)nnc2c1
InChIInChI=1S/C8H10N4/c1-6-2-3-12-7(4-6)10-11-8(12)5-9/h2-4H,5,9H2,1H3
InChIKeyHMYNVTFOMRVVHM-UHFFFAOYSA-N
XLogP0.50
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The IUPAC name of (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine (CID 55266770) is (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine.
What is the SMILES notation for (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The canonical SMILES for (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine is Cc1ccn2c(CN)nnc2c1.
What is the InChIKey of (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The InChIKey is HMYNVTFOMRVVHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-6-2-3-12-7(4-6)10-11-8(12)5-9/h2-4H,5,9H2,1H3.
What are the key properties of (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine has a molecular weight of 162.20 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine is sourced from PubChem (CID 55266770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).