7-chloro-8-fluoro-8H-quinolin-2-one

C9H5ClFNO — CID 138058931

IUPAC7-chloro-8-fluoro-8H-quinolin-2-one
SMILESO=C1C=CC2=CC=C(Cl)C(F)C2=N1
InChIInChI=1S/C9H5ClFNO/c10-6-3-1-5-2-4-7(13)12-9(5)8(6)11/h1-4,8H
InChIKeyOTWKWAAXILWBRO-UHFFFAOYSA-N
MW197.60 g/mol
LogP1.92
Rot. Bonds

About 7-chloro-8-fluoro-8H-quinolin-2-one

7-chloro-8-fluoro-8H-quinolin-2-one (PubChem CID 138058931) has the molecular formula C9H5ClFNO and a molecular weight of 197.60 g/mol. Its IUPAC name is 7-chloro-8-fluoro-8H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-8-fluoro-8H-quinolin-2-one
PubChem CID138058931
Molecular FormulaC9H5ClFNO
Molecular Weight197.60 g/mol
Exact Mass197.00
IUPAC Name7-chloro-8-fluoro-8H-quinolin-2-one
SMILESO=C1C=CC2=CC=C(Cl)C(F)C2=N1
InChIInChI=1S/C9H5ClFNO/c10-6-3-1-5-2-4-7(13)12-9(5)8(6)11/h1-4,8H
InChIKeyOTWKWAAXILWBRO-UHFFFAOYSA-N
XLogP1.92
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.60
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-(2-Chloroethyl)-6-fluoroindol-2-one
CID 142631364
7-Chloro-3-fluoroindol-2-one
CID 149947713
4-(1-Chloroethyl)-3-fluoroindol-2-one
CID 150265423
4-Chloro-5-fluoroindol-2-one
CID 152256182
7-Chloro-5-fluoroindol-2-one
CID 160921302
4,5-Difluoro-3-methylidenequinolin-2-one
CID 174791263
6-fluoro-6H-quinolin-2-one
CID 71303965
8-fluoro-4aH-quinolin-2-one
CID 71304098
4-chloro-8-(trifluoromethyl)-8H-quinolin-2-one
CID 71650402
6-fluoro-4aH-quinolin-2-one
CID 71650447
8-fluoro-8H-quinolin-2-one
CID 71650474
6-fluoro-4-(trifluoromethyl)-6H-quinolin-2-one
CID 73083461

Frequently Asked Questions

What is the IUPAC name of 7-chloro-8-fluoro-8H-quinolin-2-one?
The IUPAC name of 7-chloro-8-fluoro-8H-quinolin-2-one (CID 138058931) is 7-chloro-8-fluoro-8H-quinolin-2-one.
What is the SMILES notation for 7-chloro-8-fluoro-8H-quinolin-2-one?
The canonical SMILES for 7-chloro-8-fluoro-8H-quinolin-2-one is O=C1C=CC2=CC=C(Cl)C(F)C2=N1.
What is the InChIKey of 7-chloro-8-fluoro-8H-quinolin-2-one?
The InChIKey is OTWKWAAXILWBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClFNO/c10-6-3-1-5-2-4-7(13)12-9(5)8(6)11/h1-4,8H.
What are the key properties of 7-chloro-8-fluoro-8H-quinolin-2-one?
7-chloro-8-fluoro-8H-quinolin-2-one has a molecular weight of 197.60 g/mol, XLogP of 1.92, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-8-fluoro-8H-quinolin-2-one is sourced from PubChem (CID 138058931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).