1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one

C17H15NO3 — CID 54716845

IUPAC1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one
SMILESCCn1c(=O)c(-c2ccccc2)c(O)c2ccc(O)cc21
InChIInChI=1S/C17H15NO3/c1-2-18-14-10-12(19)8-9-13(14)16(20)15(17(18)21)11-6-4-3-5-7-11/h3-10,19-20H,2H2,1H3
InChIKeySBEPRMZQPSKAHP-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.10
Rot. Bonds2

About 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one

1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one (PubChem CID 54716845) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one.

Molecular Properties

Compound Name1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one
PubChem CID54716845
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one
SMILESCCn1c(=O)c(-c2ccccc2)c(O)c2ccc(O)cc21
InChIInChI=1S/C17H15NO3/c1-2-18-14-10-12(19)8-9-13(14)16(20)15(17(18)21)11-6-4-3-5-7-11/h3-10,19-20H,2H2,1H3
InChIKeySBEPRMZQPSKAHP-UHFFFAOYSA-N
XLogP3.10
TPSA62.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-diethyl-2-(4-hydroxyphenyl)indol-6-ol
CID 13408386
1-ethyl-3-[(Z)-hydrazinylidenemethyl]-4-hydroxyquinolin-2-one
CID 136671574
1-ethyl-3-[(E)-hydrazinylidenemethyl]-4-hydroxyquinolin-2-one
CID 135679488
4-chloro-1-ethyl-3-phenylquinolin-2-one
CID 139216417
1,3-diethyl-4-hydroxy-7-methylquinolin-2-one
CID 54703297
1-ethyl-7-(fluoromethyl)-3-methoxy-4-phenylquinolin-2-one
CID 142438232
(1-ethyl-2-oxo-3-phenylquinolin-4-yl) dihydrogen phosphate
CID 139216427
5-ethyl-4-hydroxy-1,3,6-triphenylpyridin-2-one
CID 54686582
4-hydroxy-7-[2-(methoxymethyl)phenyl]-1-methyl-3-(4-phenoxyphenyl)quinolin-2-one
CID 130399414
1-butyl-7-hydroxy-3,4-bis(phenylmethoxy)quinolin-2-one
CID 139717687
1-butyl-4,7-dihydroxy-3-octoxyquinolin-2-one
CID 139717591
3-hexoxy-4,7-dihydroxy-1-octylquinolin-2-one
CID 139718563

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one?
The IUPAC name of 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one (CID 54716845) is 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one.
What is the SMILES notation for 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one?
The canonical SMILES for 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one is CCn1c(=O)c(-c2ccccc2)c(O)c2ccc(O)cc21.
What is the InChIKey of 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one?
The InChIKey is SBEPRMZQPSKAHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-2-18-14-10-12(19)8-9-13(14)16(20)15(17(18)21)11-6-4-3-5-7-11/h3-10,19-20H,2H2,1H3.
What are the key properties of 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one?
1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one has a molecular weight of 281.31 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4,7-dihydroxy-3-phenylquinolin-2-one is sourced from PubChem (CID 54716845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).