(4-oxo-3-pyridin-2-ylchromen-7-yl) formate

C15H9NO4 — CID 4645423

IUPAC(4-oxo-3-pyridin-2-ylchromen-7-yl) formate
SMILESO=COc1ccc2c(=O)c(-c3ccccn3)coc2c1
InChIInChI=1S/C15H9NO4/c17-9-20-10-4-5-11-14(7-10)19-8-12(15(11)18)13-3-1-2-6-16-13/h1-9H
InChIKeyKRIALDQWMIJJQT-UHFFFAOYSA-N
MW267.24 g/mol
LogP2.39
Rot. Bonds3

About (4-oxo-3-pyridin-2-ylchromen-7-yl) formate

(4-oxo-3-pyridin-2-ylchromen-7-yl) formate (PubChem CID 4645423) has the molecular formula C15H9NO4 and a molecular weight of 267.24 g/mol. Its IUPAC name is (4-oxo-3-pyridin-2-ylchromen-7-yl) formate.

Molecular Properties

Compound Name(4-oxo-3-pyridin-2-ylchromen-7-yl) formate
PubChem CID4645423
Molecular FormulaC15H9NO4
Molecular Weight267.24 g/mol
Exact Mass267.05
IUPAC Name(4-oxo-3-pyridin-2-ylchromen-7-yl) formate
SMILESO=COc1ccc2c(=O)c(-c3ccccn3)coc2c1
InChIInChI=1S/C15H9NO4/c17-9-20-10-4-5-11-14(7-10)19-8-12(15(11)18)13-3-1-2-6-16-13/h1-9H
InChIKeyKRIALDQWMIJJQT-UHFFFAOYSA-N
XLogP2.39
TPSA69.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.24
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (4-oxo-3-pyridin-2-ylchromen-7-yl) formate with MolForge

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

Launch Full Analysis

Related Compounds

[4-oxo-3-(1,3-thiazol-4-yl)chromen-7-yl] formate
CID 945075
sodium 2-(4-oxo-3-pyridin-2-ylchromen-7-yl)oxyacetate
CID 23704767
3-pyridin-2-yl-7-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
CID 9179235
6-ethyl-7-methoxy-3-pyridin-2-ylchromen-4-one
CID 854598
7-methoxy-6-propyl-3-pyridin-2-ylchromen-4-one
CID 740743
(6-ethyl-4-oxo-3-pyridin-2-ylchromen-7-yl) acetate
CID 740771
2-(4-oxo-3-phenylchromen-7-yl)oxyacetic acid
CID 15122627
5,7-dihydroxy-3-pyridin-2-ylchromen-4-one
CID 5413046
7-methoxy-3-[(pyridin-2-ylhydrazinylidene)methyl]chromen-4-one
CID 70622612
7-[(3-nitro-2-pyridinyl)oxy]-3-phenylchromen-4-one
CID 134045192
2-[3-(2-methoxyphenyl)-4-oxochromen-7-yl]oxyacetamide
CID 906607
[2-oxo-2-(4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl)oxyethyl]azanium
CID 6954988

Frequently Asked Questions

What is the IUPAC name of (4-oxo-3-pyridin-2-ylchromen-7-yl) formate?
The IUPAC name of (4-oxo-3-pyridin-2-ylchromen-7-yl) formate (CID 4645423) is (4-oxo-3-pyridin-2-ylchromen-7-yl) formate.
What is the SMILES notation for (4-oxo-3-pyridin-2-ylchromen-7-yl) formate?
The canonical SMILES for (4-oxo-3-pyridin-2-ylchromen-7-yl) formate is O=COc1ccc2c(=O)c(-c3ccccn3)coc2c1.
What is the InChIKey of (4-oxo-3-pyridin-2-ylchromen-7-yl) formate?
The InChIKey is KRIALDQWMIJJQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9NO4/c17-9-20-10-4-5-11-14(7-10)19-8-12(15(11)18)13-3-1-2-6-16-13/h1-9H.
What are the key properties of (4-oxo-3-pyridin-2-ylchromen-7-yl) formate?
(4-oxo-3-pyridin-2-ylchromen-7-yl) formate has a molecular weight of 267.24 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-oxo-3-pyridin-2-ylchromen-7-yl) formate is sourced from PubChem (CID 4645423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).