N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide

C19H15N7O2 — CID 71710266

IUPACN-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide
SMILESO=C(CNC(=O)c1cnccn1)Nc1ccc(-c2nnc3ccccn23)cc1
InChIInChI=1S/C19H15N7O2/c27-17(12-22-19(28)15-11-20-8-9-21-15)23-14-6-4-13(5-7-14)18-25-24-16-3-1-2-10-26(16)18/h1-11H,12H2,(H,22,28)(H,23,27)
InChIKeyLPSBJYFOZAFVNC-UHFFFAOYSA-N
MW373.38 g/mol
LogP1.55
Rot. Bonds5

About N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide

N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide (PubChem CID 71710266) has the molecular formula C19H15N7O2 and a molecular weight of 373.38 g/mol. Its IUPAC name is N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide
PubChem CID71710266
Molecular FormulaC19H15N7O2
Molecular Weight373.38 g/mol
Exact Mass373.13
IUPAC NameN-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide
SMILESO=C(CNC(=O)c1cnccn1)Nc1ccc(-c2nnc3ccccn23)cc1
InChIInChI=1S/C19H15N7O2/c27-17(12-22-19(28)15-11-20-8-9-21-15)23-14-6-4-13(5-7-14)18-25-24-16-3-1-2-10-26(16)18/h1-11H,12H2,(H,22,28)(H,23,27)
InChIKeyLPSBJYFOZAFVNC-UHFFFAOYSA-N
XLogP1.55
TPSA114.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.38
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide 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-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide (CID 71710266) is N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide is O=C(CNC(=O)c1cnccn1)Nc1ccc(-c2nnc3ccccn23)cc1.
What is the InChIKey of N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide?
The InChIKey is LPSBJYFOZAFVNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N7O2/c27-17(12-22-19(28)15-11-20-8-9-21-15)23-14-6-4-13(5-7-14)18-25-24-16-3-1-2-10-26(16)18/h1-11H,12H2,(H,22,28)(H,23,27).
What are the key properties of N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide?
N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide has a molecular weight of 373.38 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)anilino]ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 71710266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).