2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C10H12N4 — CID 53190755

IUPAC2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESNc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C10H12N4/c11-8-5-2-6-14-10(8)12-9(13-14)7-3-1-4-7/h2,5-7H,1,3-4,11H2
InChIKeyMGDWOEJECQTOTN-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.58
Rot. Bonds1

About 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine

2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 53190755) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID53190755
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESNc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C10H12N4/c11-8-5-2-6-14-10(8)12-9(13-14)7-3-1-4-7/h2,5-7H,1,3-4,11H2
InChIKeyMGDWOEJECQTOTN-UHFFFAOYSA-N
XLogP1.58
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 53190755) is 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine is Nc1cccn2nc(C3CCC3)nc12.
What is the InChIKey of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is MGDWOEJECQTOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c11-8-5-2-6-14-10(8)12-9(13-14)7-3-1-4-7/h2,5-7H,1,3-4,11H2.
What are the key properties of 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 188.23 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 53190755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).