1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone

C11H12FNO2 — CID 132513887

IUPAC1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
SMILESCC(=O)N1CCCc2cc(O)c(F)cc21
InChIInChI=1S/C11H12FNO2/c1-7(14)13-4-2-3-8-5-11(15)9(12)6-10(8)13/h5-6,15H,2-4H2,1H3
InChIKeyJVPHNKXHVGVXBU-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.83
Rot. Bonds

About 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone

1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone (PubChem CID 132513887) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone.

Molecular Properties

Compound Name1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
PubChem CID132513887
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
SMILESCC(=O)N1CCCc2cc(O)c(F)cc21
InChIInChI=1S/C11H12FNO2/c1-7(14)13-4-2-3-8-5-11(15)9(12)6-10(8)13/h5-6,15H,2-4H2,1H3
InChIKeyJVPHNKXHVGVXBU-UHFFFAOYSA-N
XLogP1.83
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6-hydroxy-7-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 14338804
1-[6-(hydroxymethyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 21254818
1-[6-bromo-7-(chloromethyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 43164780
1-(3,4-dihydro-2H-quinolin-1-yl)ethanone;ethane
CID 143423489
2-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)acetic acid
CID 20618502
1-(5-fluoro-6-methylsulfonyl-2,3-dihydroindol-1-yl)ethanone
CID 59468850
1-[6-(2,2-dimethylpropyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 91584426
sodium 1-acetyl-3,4-dihydro-2H-quinoline-6-sulfonate
CID 112704982
1-[6-(2-bromoethyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 82254868
1-[6-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]ethanone
CID 83967651
N'-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-N-(3-fluorophenyl)oxamide
CID 7586378
(3,4-difluorophenyl) 1-acetyl-3,4-dihydro-2H-quinoline-6-sulfonate
CID 51544921

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone?
The IUPAC name of 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone (CID 132513887) is 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone.
What is the SMILES notation for 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone?
The canonical SMILES for 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone is CC(=O)N1CCCc2cc(O)c(F)cc21.
What is the InChIKey of 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone?
The InChIKey is JVPHNKXHVGVXBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-7(14)13-4-2-3-8-5-11(15)9(12)6-10(8)13/h5-6,15H,2-4H2,1H3.
What are the key properties of 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone?
1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone has a molecular weight of 209.22 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoro-6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone is sourced from PubChem (CID 132513887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).