1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one

C12H13N3O — CID 83835612

IUPAC1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one
SMILESCC(=O)Cc1cccc2nc(C3CC3)nn12
InChIInChI=1S/C12H13N3O/c1-8(16)7-10-3-2-4-11-13-12(9-5-6-9)14-15(10)11/h2-4,9H,5-7H2,1H3
InChIKeyCKTPBTMPSWHBQF-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.74
Rot. Bonds3

About 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one

1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one (PubChem CID 83835612) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one.

Molecular Properties

Compound Name1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one
PubChem CID83835612
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one
SMILESCC(=O)Cc1cccc2nc(C3CC3)nn12
InChIInChI=1S/C12H13N3O/c1-8(16)7-10-3-2-4-11-13-12(9-5-6-9)14-15(10)11/h2-4,9H,5-7H2,1H3
InChIKeyCKTPBTMPSWHBQF-UHFFFAOYSA-N
XLogP1.74
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one?
The IUPAC name of 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one (CID 83835612) is 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one.
What is the SMILES notation for 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one?
The canonical SMILES for 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one is CC(=O)Cc1cccc2nc(C3CC3)nn12.
What is the InChIKey of 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one?
The InChIKey is CKTPBTMPSWHBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-8(16)7-10-3-2-4-11-13-12(9-5-6-9)14-15(10)11/h2-4,9H,5-7H2,1H3.
What are the key properties of 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one?
1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one has a molecular weight of 215.26 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)propan-2-one is sourced from PubChem (CID 83835612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).