N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide

C21H16N2O4 — CID 140833545

IUPACN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide
SMILESCC1(c2ccnc3ccccc23)OC(NC(=O)c2ccccc2)=C(O)C1=O
InChIInChI=1S/C21H16N2O4/c1-21(15-11-12-22-16-10-6-5-9-14(15)16)18(25)17(24)20(27-21)23-19(26)13-7-3-2-4-8-13/h2-12,24H,1H3,(H,23,26)
InChIKeyQHWRBEQJRPUJDX-UHFFFAOYSA-N
MW360.37 g/mol
LogP3.21
Rot. Bonds3

About N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide

N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide (PubChem CID 140833545) has the molecular formula C21H16N2O4 and a molecular weight of 360.37 g/mol. Its IUPAC name is N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide.

Molecular Properties

Compound NameN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide
PubChem CID140833545
Molecular FormulaC21H16N2O4
Molecular Weight360.37 g/mol
Exact Mass360.11
IUPAC NameN-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide
SMILESCC1(c2ccnc3ccccc23)OC(NC(=O)c2ccccc2)=C(O)C1=O
InChIInChI=1S/C21H16N2O4/c1-21(15-11-12-22-16-10-6-5-9-14(15)16)18(25)17(24)20(27-21)23-19(26)13-7-3-2-4-8-13/h2-12,24H,1H3,(H,23,26)
InChIKeyQHWRBEQJRPUJDX-UHFFFAOYSA-N
XLogP3.21
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)carbamic acid
CID 151957017
5-amino-4-hydroxy-2-methyl-2-quinolin-4-ylfuran-3-one
CID 90081981
N-(3-hydroxy-5-methyl-4-oxo-5-pyridin-3-ylfuran-2-yl)benzamide
CID 140833703
N-[5-(3,5-difluorophenyl)-3-hydroxy-5-methyl-4-oxofuran-2-yl]benzamide
CID 140834390
1-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)pyrrolidine-2,5-dione
CID 140833786
[2-(benzenesulfonamido)-5-methyl-4-oxo-5-quinolin-4-ylfuran-3-yl] acetate
CID 140834438
methyl 1-quinolin-4-ylcyclopropane-1-carboxylate
CID 116985439
N-phenyl-4-(quinolin-4-ylamino)benzamide
CID 58472461
N-acridin-9-ylbenzamide
CID 40532924
[2-benzamido-5-(3,5-difluorophenyl)-5-methyl-4-oxofuran-3-yl] acetate
CID 140833950
N-(4-oxo-3,1-benzoxazin-2-yl)benzamide
CID 10400687
(quinolin-4-ylamino) benzoate
CID 23468711

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide?
The IUPAC name of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide (CID 140833545) is N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide.
What is the SMILES notation for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide?
The canonical SMILES for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide is CC1(c2ccnc3ccccc23)OC(NC(=O)c2ccccc2)=C(O)C1=O.
What is the InChIKey of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide?
The InChIKey is QHWRBEQJRPUJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O4/c1-21(15-11-12-22-16-10-6-5-9-14(15)16)18(25)17(24)20(27-21)23-19(26)13-7-3-2-4-8-13/h2-12,24H,1H3,(H,23,26).
What are the key properties of N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide?
N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide has a molecular weight of 360.37 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-4-ylfuran-2-yl)benzamide is sourced from PubChem (CID 140833545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).