1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone

C17H12FNO — CID 82540926

IUPAC1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone
SMILESCC(=O)c1ccc(F)c(-c2cccc3cccnc23)c1
InChIInChI=1S/C17H12FNO/c1-11(20)13-7-8-16(18)15(10-13)14-6-2-4-12-5-3-9-19-17(12)14/h2-10H,1H3
InChIKeyKJYIDUZEWZWXOE-UHFFFAOYSA-N
MW265.29 g/mol
LogP4.24
Rot. Bonds2

About 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone

1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone (PubChem CID 82540926) has the molecular formula C17H12FNO and a molecular weight of 265.29 g/mol. Its IUPAC name is 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone
PubChem CID82540926
Molecular FormulaC17H12FNO
Molecular Weight265.29 g/mol
Exact Mass265.09
IUPAC Name1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone
SMILESCC(=O)c1ccc(F)c(-c2cccc3cccnc23)c1
InChIInChI=1S/C17H12FNO/c1-11(20)13-7-8-16(18)15(10-13)14-6-2-4-12-5-3-9-19-17(12)14/h2-10H,1H3
InChIKeyKJYIDUZEWZWXOE-UHFFFAOYSA-N
XLogP4.24
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluoro-4-quinolin-8-yloxyphenyl)ethanone
CID 28825225
1-(4-fluoro-3-pyridin-3-ylphenyl)ethanone
CID 82541383
1-[4-fluoro-3-(4-methyl-2-pyridinyl)phenyl]ethanone
CID 177459934
5-methyl-4-quinolin-8-yl-1H-pyrrole-2-carboxylic acid
CID 122568161
acetic acid;palladium;bis(1,10-phenanthroline)
CID 11261760
1-(8-fluoroquinolin-3-yl)ethanone
CID 75355413
1-[3-(quinolin-8-ylmethylsulfanyl)phenyl]ethanone
CID 64661704
1-[3-(7-chloro-1-benzofuran-2-yl)-4-fluorophenyl]ethanone
CID 114732126
1-[3-(2-quinolin-8-yloxyethoxy)phenyl]ethanone
CID 2993304
methyl 3-quinolin-8-ylbenzoate
CID 4189037
7-fluoroquinoline-8-carboxylic acid
CID 71721093
1-(8-nitroquinolin-6-yl)ethanone
CID 166162234

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone?
The IUPAC name of 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone (CID 82540926) is 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone.
What is the SMILES notation for 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone?
The canonical SMILES for 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone is CC(=O)c1ccc(F)c(-c2cccc3cccnc23)c1.
What is the InChIKey of 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone?
The InChIKey is KJYIDUZEWZWXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO/c1-11(20)13-7-8-16(18)15(10-13)14-6-2-4-12-5-3-9-19-17(12)14/h2-10H,1H3.
What are the key properties of 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone?
1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone has a molecular weight of 265.29 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3-quinolin-8-ylphenyl)ethanone is sourced from PubChem (CID 82540926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).