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

C8H10N4 — CID 24706404

IUPACN-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
SMILESCNCc1nnc2ccccn12
InChIInChI=1S/C8H10N4/c1-9-6-8-11-10-7-4-2-3-5-12(7)8/h2-5,9H,6H2,1H3
InChIKeyUQXCTICEXNDHAR-UHFFFAOYSA-N
MW162.20 g/mol
LogP0.45
Rot. Bonds2

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

N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine (PubChem CID 24706404) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
PubChem CID24706404
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC NameN-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine
SMILESCNCc1nnc2ccccn12
InChIInChI=1S/C8H10N4/c1-9-6-8-11-10-7-4-2-3-5-12(7)8/h2-5,9H,6H2,1H3
InChIKeyUQXCTICEXNDHAR-UHFFFAOYSA-N
XLogP0.45
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The IUPAC name of N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine (CID 24706404) is N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The canonical SMILES for N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine is CNCc1nnc2ccccn12.
What is the InChIKey of N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
The InChIKey is UQXCTICEXNDHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-9-6-8-11-10-7-4-2-3-5-12(7)8/h2-5,9H,6H2,1H3.
What are the key properties of N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine?
N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine has a molecular weight of 162.20 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine is sourced from PubChem (CID 24706404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).