N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide

C9H8N4O — CID 154766209

IUPACN-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide
SMILESC=CC(=O)Nc1nc2ccccn2n1
InChIInChI=1S/C9H8N4O/c1-2-8(14)11-9-10-7-5-3-4-6-13(7)12-9/h2-6H,1H2,(H,11,12,14)
InChIKeyOVIUGEJTXANLDS-UHFFFAOYSA-N
MW188.19 g/mol
LogP0.85
Rot. Bonds2

About N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide

N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide (PubChem CID 154766209) has the molecular formula C9H8N4O and a molecular weight of 188.19 g/mol. Its IUPAC name is N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide.

Molecular Properties

Compound NameN-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide
PubChem CID154766209
Molecular FormulaC9H8N4O
Molecular Weight188.19 g/mol
Exact Mass188.07
IUPAC NameN-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide
SMILESC=CC(=O)Nc1nc2ccccn2n1
InChIInChI=1S/C9H8N4O/c1-2-8(14)11-9-10-7-5-3-4-6-13(7)12-9/h2-6H,1H2,(H,11,12,14)
InChIKeyOVIUGEJTXANLDS-UHFFFAOYSA-N
XLogP0.85
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide 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 N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide?
The IUPAC name of N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide (CID 154766209) is N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide.
What is the SMILES notation for N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide?
The canonical SMILES for N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide is C=CC(=O)Nc1nc2ccccn2n1.
What is the InChIKey of N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide?
The InChIKey is OVIUGEJTXANLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O/c1-2-8(14)11-9-10-7-5-3-4-6-13(7)12-9/h2-6H,1H2,(H,11,12,14).
What are the key properties of N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide?
N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide has a molecular weight of 188.19 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)prop-2-enamide is sourced from PubChem (CID 154766209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).