(2-benzamido-2-oxoethyl) pyridine-2-carboxylate

C15H12N2O4 — CID 7477399

IUPAC(2-benzamido-2-oxoethyl) pyridine-2-carboxylate
SMILESO=C(COC(=O)c1ccccn1)NC(=O)c1ccccc1
InChIInChI=1S/C15H12N2O4/c18-13(17-14(19)11-6-2-1-3-7-11)10-21-15(20)12-8-4-5-9-16-12/h1-9H,10H2,(H,17,18,19)
InChIKeyYIFXXSOLHFQWHT-UHFFFAOYSA-N
MW284.27 g/mol
LogP1.20
Rot. Bonds4

About (2-benzamido-2-oxoethyl) pyridine-2-carboxylate

(2-benzamido-2-oxoethyl) pyridine-2-carboxylate (PubChem CID 7477399) has the molecular formula C15H12N2O4 and a molecular weight of 284.27 g/mol. Its IUPAC name is (2-benzamido-2-oxoethyl) pyridine-2-carboxylate.

Molecular Properties

Compound Name(2-benzamido-2-oxoethyl) pyridine-2-carboxylate
PubChem CID7477399
Molecular FormulaC15H12N2O4
Molecular Weight284.27 g/mol
Exact Mass284.08
IUPAC Name(2-benzamido-2-oxoethyl) pyridine-2-carboxylate
SMILESO=C(COC(=O)c1ccccn1)NC(=O)c1ccccc1
InChIInChI=1S/C15H12N2O4/c18-13(17-14(19)11-6-2-1-3-7-11)10-21-15(20)12-8-4-5-9-16-12/h1-9H,10H2,(H,17,18,19)
InChIKeyYIFXXSOLHFQWHT-UHFFFAOYSA-N
XLogP1.20
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2-benzamido-2-oxoethyl) pyridine-2-carboxylate 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 (2-benzamido-2-oxoethyl) pyridine-2-carboxylate?
The IUPAC name of (2-benzamido-2-oxoethyl) pyridine-2-carboxylate (CID 7477399) is (2-benzamido-2-oxoethyl) pyridine-2-carboxylate.
What is the SMILES notation for (2-benzamido-2-oxoethyl) pyridine-2-carboxylate?
The canonical SMILES for (2-benzamido-2-oxoethyl) pyridine-2-carboxylate is O=C(COC(=O)c1ccccn1)NC(=O)c1ccccc1.
What is the InChIKey of (2-benzamido-2-oxoethyl) pyridine-2-carboxylate?
The InChIKey is YIFXXSOLHFQWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O4/c18-13(17-14(19)11-6-2-1-3-7-11)10-21-15(20)12-8-4-5-9-16-12/h1-9H,10H2,(H,17,18,19).
What are the key properties of (2-benzamido-2-oxoethyl) pyridine-2-carboxylate?
(2-benzamido-2-oxoethyl) pyridine-2-carboxylate has a molecular weight of 284.27 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzamido-2-oxoethyl) pyridine-2-carboxylate is sourced from PubChem (CID 7477399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).