N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide

C20H14N2O3 — CID 66675664

IUPACN-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ccccc1-c1ccoc1)c1c[nH]c2ccccc2c1=O
InChIInChI=1S/C20H14N2O3/c23-19-15-6-2-3-7-17(15)21-11-16(19)20(24)22-18-8-4-1-5-14(18)13-9-10-25-12-13/h1-12H,(H,21,23)(H,22,24)
InChIKeyHGAAUJDFZLUOEB-UHFFFAOYSA-N
MW330.34 g/mol
LogP4.04
Rot. Bonds3

About N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide

N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide (PubChem CID 66675664) has the molecular formula C20H14N2O3 and a molecular weight of 330.34 g/mol. Its IUPAC name is N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide
PubChem CID66675664
Molecular FormulaC20H14N2O3
Molecular Weight330.34 g/mol
Exact Mass330.10
IUPAC NameN-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1ccccc1-c1ccoc1)c1c[nH]c2ccccc2c1=O
InChIInChI=1S/C20H14N2O3/c23-19-15-6-2-3-7-17(15)21-11-16(19)20(24)22-18-8-4-1-5-14(18)13-9-10-25-12-13/h1-12H,(H,21,23)(H,22,24)
InChIKeyHGAAUJDFZLUOEB-UHFFFAOYSA-N
XLogP4.04
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-(2-methylphenyl)-4-oxo-1H-quinoline-3-carboxamide;propane
CID 90785095
N-(2,5-difluorophenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 30131667
N-(5-hydroxy-2-methylphenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 169084828
N-(2-hydroxyphenyl)-1H-indole-3-carboxamide
CID 57210773
N-[4-(dimethylamino)phenyl]-4-oxo-1H-quinoline-3-carboxamide
CID 13151201
N-(2,5-dichloro-3-pyridinyl)-4-oxo-1H-quinoline-3-carboxamide
CID 87101826
4-oxo-N-(2-phenylphenyl)-7H-thieno[2,3-b]pyridine-5-carboxamide
CID 59396787
N-cyano-4-oxo-1H-quinoline-3-carboxamide
CID 79195085
N-[2-[(cyclohexylmethylamino)methyl]phenyl]-4-oxo-1H-quinoline-3-carboxamide
CID 66675127
N-[4-[dimethyl(trideuteriomethyl)silyl]-5-hydroxy-2-[methyl-bis(trideuteriomethyl)silyl]phenyl]-4-oxo-1H-quinoline-3-carboxamide
CID 161023166
N-(4-tert-butyl-5-hydroxy-2-methylphenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 53247257
3-[(4-oxo-1H-quinoline-3-carbonyl)amino]benzoic acid
CID 679194

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide (CID 66675664) is N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide is O=C(Nc1ccccc1-c1ccoc1)c1c[nH]c2ccccc2c1=O.
What is the InChIKey of N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide?
The InChIKey is HGAAUJDFZLUOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O3/c23-19-15-6-2-3-7-17(15)21-11-16(19)20(24)22-18-8-4-1-5-14(18)13-9-10-25-12-13/h1-12H,(H,21,23)(H,22,24).
What are the key properties of N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide?
N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide has a molecular weight of 330.34 g/mol, XLogP of 4.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-3-yl)phenyl]-4-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 66675664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).