2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide

C20H14N2O3 — CID 110745561

IUPAC2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide
SMILESO=C(NCc1ccc2ccccc2n1)c1cc2ccccc2oc1=O
InChIInChI=1S/C20H14N2O3/c23-19(16-11-14-6-2-4-8-18(14)25-20(16)24)21-12-15-10-9-13-5-1-3-7-17(13)22-15/h1-11H,12H2,(H,21,23)
InChIKeyVWZGIOSYTQIXIF-UHFFFAOYSA-N
MW330.34 g/mol
LogP3.27
Rot. Bonds3

About 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide

2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide (PubChem CID 110745561) has the molecular formula C20H14N2O3 and a molecular weight of 330.34 g/mol. Its IUPAC name is 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide
PubChem CID110745561
Molecular FormulaC20H14N2O3
Molecular Weight330.34 g/mol
Exact Mass330.10
IUPAC Name2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide
SMILESO=C(NCc1ccc2ccccc2n1)c1cc2ccccc2oc1=O
InChIInChI=1S/C20H14N2O3/c23-19(16-11-14-6-2-4-8-18(14)25-20(16)24)21-12-15-10-9-13-5-1-3-7-17(13)22-15/h1-11H,12H2,(H,21,23)
InChIKeyVWZGIOSYTQIXIF-UHFFFAOYSA-N
XLogP3.27
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 53.27
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

N-[(5-acetyl-6-methyl-2-pyridinyl)methyl]-2-oxochromene-3-carboxamide
CID 75435887
2-oxo-N-[(6-phenylpyrimidin-4-yl)methyl]chromene-3-carboxamide
CID 122261785
N-[(2-benzyl-1,3-thiazol-4-yl)methyl]-2-oxochromene-3-carboxamide
CID 108737563
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]-2-oxochromene-3-carboxamide
CID 56786046
N-(2,2-dimethylpropyl)-2-oxochromene-3-carboxamide
CID 110473782
N-[[4-(benzimidazol-1-ylmethyl)phenyl]methyl]-2-oxochromene-3-carboxamide
CID 49047426
N-[[6-(4-methoxyphenyl)pyrimidin-4-yl]methyl]-2-oxochromene-3-carboxamide
CID 122262283
N-(1,3-benzodioxol-5-ylmethyl)-2-oxochromene-3-carboxamide
CID 775794
2-oxo-N-[2-(1,3-thiazol-2-yl)ethyl]chromene-3-carboxamide
CID 49357043
N-[(2-methoxy-3-pyridinyl)methyl]-2-oxochromene-3-carboxamide
CID 37486429
2-oxo-N-[[5-(thiophene-2-carbonyl)thiophen-2-yl]methyl]chromene-3-carboxamide
CID 121131705
2-oxo-N-[(4-pyrazol-1-ylphenyl)methyl]chromene-3-carboxamide
CID 17354240

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide?
The IUPAC name of 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide (CID 110745561) is 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide.
What is the SMILES notation for 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide?
The canonical SMILES for 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide is O=C(NCc1ccc2ccccc2n1)c1cc2ccccc2oc1=O.
What is the InChIKey of 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide?
The InChIKey is VWZGIOSYTQIXIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O3/c23-19(16-11-14-6-2-4-8-18(14)25-20(16)24)21-12-15-10-9-13-5-1-3-7-17(13)22-15/h1-11H,12H2,(H,21,23).
What are the key properties of 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide?
2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide has a molecular weight of 330.34 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(quinolin-2-ylmethyl)chromene-3-carboxamide is sourced from PubChem (CID 110745561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).