4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide

C18H16N2O3 — CID 54676478

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IUPAC4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide
SMILESCN(C(=O)c1c(O)c2ccccc2n(C)c1=O)c1ccccc1
InChIInChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3
InChIKeySGOOQMRIPALTEL-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.52
Rot. Bonds2

About 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide

4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide (PubChem CID 54676478) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide
PubChem CID54676478
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC Name4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide
SMILESCN(C(=O)c1c(O)c2ccccc2n(C)c1=O)c1ccccc1
InChIInChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3
InChIKeySGOOQMRIPALTEL-UHFFFAOYSA-N
XLogP2.52
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Laquinimod
CID 54677946
3-Quinolinecarboxylic acid, 1,2-dihydro-4-hydroxy-1-methyl-2-oxo-, ethyl ester
CID 54682929
beta-Hydroxyfentanyl
CID 62278
4-Hydroxy-N-methylcarbostyril
CID 54686436
Paquinimod
CID 54684617
3-Quinolinecarboxamide, 1,2-dihydro-N-hexyl-4-hydroxy-2-oxo-
CID 54677800
N-(1-Benzyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonyl)glycine
CID 54685215
N-benzyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54680441
3-Benzylquinoline-2,4-diol
CID 54680363
1-Benzyl-4-hydroxyquinolin-2(1H)-one
CID 54680863
4-Hydroxy-1-methyl-3-phenyl-1,2-dihydroquinolin-2-one
CID 54680431
3-Quinolinecarboxamide, 1,2-dihydro-N-ethyl-4-hydroxy-2-oxo-
CID 54680440

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide (CID 54676478) is 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide is CN(C(=O)c1c(O)c2ccccc2n(C)c1=O)c1ccccc1.
What is the InChIKey of 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide?
The InChIKey is SGOOQMRIPALTEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-19(12-8-4-3-5-9-12)17(22)15-16(21)13-10-6-7-11-14(13)20(2)18(15)23/h3-11,21H,1-2H3.
What are the key properties of 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide?
4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide is sourced from PubChem (CID 54676478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).