6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide

C20H14N2O3 — CID 24860439

IUPAC6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide
SMILESCc1ccc2oc(=O)c(C(=O)Nc3cnc4ccccc4c3)cc2c1
InChIInChI=1S/C20H14N2O3/c1-12-6-7-18-14(8-12)10-16(20(24)25-18)19(23)22-15-9-13-4-2-3-5-17(13)21-11-15/h2-11H,1H3,(H,22,23)
InChIKeyVZCIAGCETBUMJW-UHFFFAOYSA-N
MW330.34 g/mol
LogP3.90
Rot. Bonds2

About 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide

6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide (PubChem CID 24860439) has the molecular formula C20H14N2O3 and a molecular weight of 330.34 g/mol. Its IUPAC name is 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide
PubChem CID24860439
Molecular FormulaC20H14N2O3
Molecular Weight330.34 g/mol
Exact Mass330.10
IUPAC Name6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide
SMILESCc1ccc2oc(=O)c(C(=O)Nc3cnc4ccccc4c3)cc2c1
InChIInChI=1S/C20H14N2O3/c1-12-6-7-18-14(8-12)10-16(20(24)25-18)19(23)22-15-9-13-4-2-3-5-17(13)21-11-15/h2-11H,1H3,(H,22,23)
InChIKeyVZCIAGCETBUMJW-UHFFFAOYSA-N
XLogP3.90
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-N-quinolin-8-ylbenzamide
CID 836519
2-ethoxy-N-quinolin-8-ylbenzamide
CID 836546
3-(4-methoxyphenyl)-N-quinolin-3-ylpropanamide
CID 5299704
3-(2-oxo-2H-chromen-3-yl)-N-(pyridin-3-yl)benzamide
CID 942378
N-[2-(1H-indol-3-yl)ethyl]-2-oxo-2H-chromene-3-carboxamide
CID 2340492
5-Methyl-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide
CID 67107177
2-[(Phenylmethyl)oxy]-N-3-pyridinyl-5-(4-pyridinyl)benzamide
CID 69936458
2-oxo-N-pyridin-4-yl-2H-chromene-3-carboxamide
CID 3236152
2H-1-Benzopyran-3-carboxamide, N-3-pyridinyl-
CID 55151
2-oxo-N-(2-pyridinylmethyl)-1-benzopyran-3-carboxamide
CID 644836
3-oxo-N-(pyridin-2-ylmethyl)-3H-benzo[f]chromene-2-carboxamide
CID 1505052
2-(2,4-dimethylphenoxy)-N-quinolin-8-ylpyridine-3-carboxamide
CID 4108474

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide?
The IUPAC name of 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide (CID 24860439) is 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide.
What is the SMILES notation for 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide?
The canonical SMILES for 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide is Cc1ccc2oc(=O)c(C(=O)Nc3cnc4ccccc4c3)cc2c1.
What is the InChIKey of 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide?
The InChIKey is VZCIAGCETBUMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O3/c1-12-6-7-18-14(8-12)10-16(20(24)25-18)19(23)22-15-9-13-4-2-3-5-17(13)21-11-15/h2-11H,1H3,(H,22,23).
What are the key properties of 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide?
6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide has a molecular weight of 330.34 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-oxo-N-quinolin-3-ylchromene-3-carboxamide is sourced from PubChem (CID 24860439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).