1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one

C23H19NO3 — CID 54729466

IUPAC1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one
SMILESO=c1cc(O)c2cc(OCc3ccccc3)ccc2n1Cc1ccccc1
InChIInChI=1S/C23H19NO3/c25-22-14-23(26)24(15-17-7-3-1-4-8-17)21-12-11-19(13-20(21)22)27-16-18-9-5-2-6-10-18/h1-14,25H,15-16H2
InChIKeyAFBVGOKHGJXPOH-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.33
Rot. Bonds5

About 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one

1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one (PubChem CID 54729466) has the molecular formula C23H19NO3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one.

Molecular Properties

Compound Name1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one
PubChem CID54729466
Molecular FormulaC23H19NO3
Molecular Weight357.41 g/mol
Exact Mass357.14
IUPAC Name1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one
SMILESO=c1cc(O)c2cc(OCc3ccccc3)ccc2n1Cc1ccccc1
InChIInChI=1S/C23H19NO3/c25-22-14-23(26)24(15-17-7-3-1-4-8-17)21-12-11-19(13-20(21)22)27-16-18-9-5-2-6-10-18/h1-14,25H,15-16H2
InChIKeyAFBVGOKHGJXPOH-UHFFFAOYSA-N
XLogP4.33
TPSA51.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-2-methyl-5-phenylmethoxyindole-3-carbaldehyde
CID 99991385
2-[1-[(4-chlorophenyl)methyl]-2-methyl-5-phenylmethoxyindol-3-yl]acetic acid
CID 19935726
2-methyl-1-(naphthalen-2-ylmethyl)-5-phenylmethoxyindole-3-carboxylic acid
CID 18373351
2-(2-hydroxy-5-phenylmethoxyphenyl)-4-phenylmethoxyphenol
CID 71613877
2-[5-methoxy-2-methyl-1-[(4-phenylmethoxyphenyl)methyl]indol-3-yl]acetic acid
CID 21191889
ethyl 1-benzyl-4-hydroxy-2-oxo-7-phenylmethoxyquinoline-3-carboxylate
CID 90796257
2-(4-chlorophenyl)-3-methyl-1-[(4-methylphenyl)methyl]-5-phenylmethoxyindole
CID 134335662
1-benzyl-5-(2-chloroethoxy)-2-methylindole-3-carboxylic acid
CID 22311809
9-[(4-methylphenyl)methyl]-6-phenylmethoxy-1,2,3,4-tetrahydrocarbazole-3-carboxylic acid
CID 141445340
1-benzyl-4-prop-2-ynoxyquinolin-2-one
CID 10085571
2-phenyl-5-phenylmethoxyphenol
CID 123808909
2-[4-[[2-(2,6-dimethylphenyl)-3-fluoro-5-phenylmethoxyindol-1-yl]methyl]phenyl]ethanol
CID 155265382

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one?
The IUPAC name of 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one (CID 54729466) is 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one.
What is the SMILES notation for 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one?
The canonical SMILES for 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one is O=c1cc(O)c2cc(OCc3ccccc3)ccc2n1Cc1ccccc1.
What is the InChIKey of 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one?
The InChIKey is AFBVGOKHGJXPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO3/c25-22-14-23(26)24(15-17-7-3-1-4-8-17)21-12-11-19(13-20(21)22)27-16-18-9-5-2-6-10-18/h1-14,25H,15-16H2.
What are the key properties of 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one?
1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one has a molecular weight of 357.41 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-hydroxy-6-phenylmethoxyquinolin-2-one is sourced from PubChem (CID 54729466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).