5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide

C17H13ClN2O3 — CID 66586693

IUPAC5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide
SMILESCn1c(=O)c(C(N)=O)c(O)c2c(Cl)c(-c3ccccc3)ccc21
InChIInChI=1S/C17H13ClN2O3/c1-20-11-8-7-10(9-5-3-2-4-6-9)14(18)12(11)15(21)13(16(19)22)17(20)23/h2-8,21H,1H3,(H2,19,22)
InChIKeyUEVDZBPMYOHWQV-UHFFFAOYSA-N
MW328.76 g/mol
LogP2.66
Rot. Bonds2

About 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide

5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide (PubChem CID 66586693) has the molecular formula C17H13ClN2O3 and a molecular weight of 328.76 g/mol. Its IUPAC name is 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide.

Molecular Properties

Compound Name5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide
PubChem CID66586693
Molecular FormulaC17H13ClN2O3
Molecular Weight328.76 g/mol
Exact Mass328.06
IUPAC Name5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide
SMILESCn1c(=O)c(C(N)=O)c(O)c2c(Cl)c(-c3ccccc3)ccc21
InChIInChI=1S/C17H13ClN2O3/c1-20-11-8-7-10(9-5-3-2-4-6-9)14(18)12(11)15(21)13(16(19)22)17(20)23/h2-8,21H,1H3,(H2,19,22)
InChIKeyUEVDZBPMYOHWQV-UHFFFAOYSA-N
XLogP2.66
TPSA85.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.76
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-1-methyl-5-(3-methylphenyl)-2-oxoquinoline-3-carboxamide
CID 172799155
N,5-diethyl-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide
CID 142791614
1-methyl-4-(methylamino)-2-oxoquinoline-3-carboxamide
CID 141068725
3-hydroxy-6-phenylbenzene-1,2-dicarboxamide
CID 68648251
6-hydroxy-1-methyl-3-phenylquinolin-2-one
CID 126596648
6-chloro-4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54717880
sodium bis(5-chloro-N-ethyl-4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide)
CID 159773761
1-(2-fluorophenyl)-2-oxo-4-phenylpyridine-3-carboxamide
CID 175752151
2,3-dichloro-4-fluoro-6-phenylbenzamide
CID 118433439
4-hydroxy-N,1-dimethyl-2-oxo-N-phenyl-5-(trifluoromethyl)quinoline-3-carboxamide
CID 54688293
3-[4-(5-carbamoyl-2-phenylphenyl)phenyl]-4-phenylbenzamide
CID 141346150
2,6-dimethyl-3-phenylbenzamide;hydrochloride
CID 175606974

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide?
The IUPAC name of 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide (CID 66586693) is 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide.
What is the SMILES notation for 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide?
The canonical SMILES for 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide is Cn1c(=O)c(C(N)=O)c(O)c2c(Cl)c(-c3ccccc3)ccc21.
What is the InChIKey of 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide?
The InChIKey is UEVDZBPMYOHWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O3/c1-20-11-8-7-10(9-5-3-2-4-6-9)14(18)12(11)15(21)13(16(19)22)17(20)23/h2-8,21H,1H3,(H2,19,22).
What are the key properties of 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide?
5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide has a molecular weight of 328.76 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-hydroxy-1-methyl-2-oxo-6-phenylquinoline-3-carboxamide is sourced from PubChem (CID 66586693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).