1-(7-fluoroquinolin-2-yl)propan-2-one

C12H10FNO — CID 82241337

IUPAC1-(7-fluoroquinolin-2-yl)propan-2-one
SMILESCC(=O)Cc1ccc2ccc(F)cc2n1
InChIInChI=1S/C12H10FNO/c1-8(15)6-11-5-3-9-2-4-10(13)7-12(9)14-11/h2-5,7H,6H2,1H3
InChIKeyONHJRXMKZSVVMT-UHFFFAOYSA-N
MW203.22 g/mol
LogP2.51
Rot. Bonds2

About 1-(7-fluoroquinolin-2-yl)propan-2-one

1-(7-fluoroquinolin-2-yl)propan-2-one (PubChem CID 82241337) has the molecular formula C12H10FNO and a molecular weight of 203.22 g/mol. Its IUPAC name is 1-(7-fluoroquinolin-2-yl)propan-2-one.

Molecular Properties

Compound Name1-(7-fluoroquinolin-2-yl)propan-2-one
PubChem CID82241337
Molecular FormulaC12H10FNO
Molecular Weight203.22 g/mol
Exact Mass203.07
IUPAC Name1-(7-fluoroquinolin-2-yl)propan-2-one
SMILESCC(=O)Cc1ccc2ccc(F)cc2n1
InChIInChI=1S/C12H10FNO/c1-8(15)6-11-5-3-9-2-4-10(13)7-12(9)14-11/h2-5,7H,6H2,1H3
InChIKeyONHJRXMKZSVVMT-UHFFFAOYSA-N
XLogP2.51
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-chloro-6-fluoroquinolin-2-yl)propan-2-one
CID 82243491
2-ethyl-7-fluoroquinoline
CID 118449779
3-(7-fluoroquinolin-2-yl)-2-methylpropanoic acid
CID 82243062
N-butan-2-yl-3-(7-fluoroquinolin-2-yl)propanamide
CID 110486620
1-(7-fluoroquinolin-2-yl)propan-2-amine
CID 82241374
3-(6-fluoroquinolin-2-yl)propanoic acid
CID 82242044
3-(6-fluoroquinolin-2-yl)-N-methylpropanamide
CID 110465204
7-fluoro-2-methyl-N-(2-quinolin-2-ylethyl)quinoline-3-carboxamide
CID 71940493
2-[[2-(6-fluoroquinolin-2-yl)acetyl]amino]propanoic acid
CID 110490402
2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide
CID 110490409
1-(6-fluoro-1-methylbenzimidazol-2-yl)propan-2-one
CID 83857937
2-(6-fluoroquinolin-2-yl)-1-piperidin-1-ylethanone
CID 110490426

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoroquinolin-2-yl)propan-2-one?
The IUPAC name of 1-(7-fluoroquinolin-2-yl)propan-2-one (CID 82241337) is 1-(7-fluoroquinolin-2-yl)propan-2-one.
What is the SMILES notation for 1-(7-fluoroquinolin-2-yl)propan-2-one?
The canonical SMILES for 1-(7-fluoroquinolin-2-yl)propan-2-one is CC(=O)Cc1ccc2ccc(F)cc2n1.
What is the InChIKey of 1-(7-fluoroquinolin-2-yl)propan-2-one?
The InChIKey is ONHJRXMKZSVVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO/c1-8(15)6-11-5-3-9-2-4-10(13)7-12(9)14-11/h2-5,7H,6H2,1H3.
What are the key properties of 1-(7-fluoroquinolin-2-yl)propan-2-one?
1-(7-fluoroquinolin-2-yl)propan-2-one has a molecular weight of 203.22 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoroquinolin-2-yl)propan-2-one is sourced from PubChem (CID 82241337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).