2-oxo-N-pyridin-4-ylchromene-3-carboxamide

C15H10N2O3 — CID 3236152

IUPAC2-oxo-N-pyridin-4-ylchromene-3-carboxamide
SMILESO=C(Nc1ccncc1)c1cc2ccccc2oc1=O
InChIInChI=1S/C15H10N2O3/c18-14(17-11-5-7-16-8-6-11)12-9-10-3-1-2-4-13(10)20-15(12)19/h1-9H,(H,16,17,18)
InChIKeyYVWRVLXMVFJFHA-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.44
Rot. Bonds2

About 2-oxo-N-pyridin-4-ylchromene-3-carboxamide

2-oxo-N-pyridin-4-ylchromene-3-carboxamide (PubChem CID 3236152) has the molecular formula C15H10N2O3 and a molecular weight of 266.26 g/mol. Its IUPAC name is 2-oxo-N-pyridin-4-ylchromene-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-pyridin-4-ylchromene-3-carboxamide
PubChem CID3236152
Molecular FormulaC15H10N2O3
Molecular Weight266.26 g/mol
Exact Mass266.07
IUPAC Name2-oxo-N-pyridin-4-ylchromene-3-carboxamide
SMILESO=C(Nc1ccncc1)c1cc2ccccc2oc1=O
InChIInChI=1S/C15H10N2O3/c18-14(17-11-5-7-16-8-6-11)12-9-10-3-1-2-4-13(10)20-15(12)19/h1-9H,(H,16,17,18)
InChIKeyYVWRVLXMVFJFHA-UHFFFAOYSA-N
XLogP2.44
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-pyridin-4-ylchromene-3-carboxamide?
The IUPAC name of 2-oxo-N-pyridin-4-ylchromene-3-carboxamide (CID 3236152) is 2-oxo-N-pyridin-4-ylchromene-3-carboxamide.
What is the SMILES notation for 2-oxo-N-pyridin-4-ylchromene-3-carboxamide?
The canonical SMILES for 2-oxo-N-pyridin-4-ylchromene-3-carboxamide is O=C(Nc1ccncc1)c1cc2ccccc2oc1=O.
What is the InChIKey of 2-oxo-N-pyridin-4-ylchromene-3-carboxamide?
The InChIKey is YVWRVLXMVFJFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O3/c18-14(17-11-5-7-16-8-6-11)12-9-10-3-1-2-4-13(10)20-15(12)19/h1-9H,(H,16,17,18).
What are the key properties of 2-oxo-N-pyridin-4-ylchromene-3-carboxamide?
2-oxo-N-pyridin-4-ylchromene-3-carboxamide has a molecular weight of 266.26 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-pyridin-4-ylchromene-3-carboxamide is sourced from PubChem (CID 3236152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).