N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide

C13H16N4O — CID 53190518

IUPACN-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide
SMILESCCC(=O)Nc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C13H16N4O/c1-2-11(18)14-10-7-4-8-17-13(10)15-12(16-17)9-5-3-6-9/h4,7-9H,2-3,5-6H2,1H3,(H,14,18)
InChIKeyMNOQVNQUFRVKNW-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.35
Rot. Bonds3

About N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide

N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide (PubChem CID 53190518) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide.

Molecular Properties

Compound NameN-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide
PubChem CID53190518
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC NameN-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide
SMILESCCC(=O)Nc1cccn2nc(C3CCC3)nc12
InChIInChI=1S/C13H16N4O/c1-2-11(18)14-10-7-4-8-17-13(10)15-12(16-17)9-5-3-6-9/h4,7-9H,2-3,5-6H2,1H3,(H,14,18)
InChIKeyMNOQVNQUFRVKNW-UHFFFAOYSA-N
XLogP2.35
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide?
The IUPAC name of N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide (CID 53190518) is N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide.
What is the SMILES notation for N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide?
The canonical SMILES for N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide is CCC(=O)Nc1cccn2nc(C3CCC3)nc12.
What is the InChIKey of N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide?
The InChIKey is MNOQVNQUFRVKNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-2-11(18)14-10-7-4-8-17-13(10)15-12(16-17)9-5-3-6-9/h4,7-9H,2-3,5-6H2,1H3,(H,14,18).
What are the key properties of N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide?
N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide has a molecular weight of 244.30 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)propanamide is sourced from PubChem (CID 53190518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).