6-chloro-4-fluoroindol-2-one

C8H3ClFNO — CID 171699771

IUPAC6-chloro-4-fluoroindol-2-one
SMILESO=C1C=c2c(F)cc(Cl)cc2=N1
InChIInChI=1S/C8H3ClFNO/c9-4-1-6(10)5-3-8(12)11-7(5)2-4/h1-3H
InChIKeyWPGUOQOOLZAQER-UHFFFAOYSA-N
MW183.57 g/mol
LogP0.42
Rot. Bonds

About 6-chloro-4-fluoroindol-2-one

6-chloro-4-fluoroindol-2-one (PubChem CID 171699771) has the molecular formula C8H3ClFNO and a molecular weight of 183.57 g/mol. Its IUPAC name is 6-chloro-4-fluoroindol-2-one.

Molecular Properties

Compound Name6-chloro-4-fluoroindol-2-one
PubChem CID171699771
Molecular FormulaC8H3ClFNO
Molecular Weight183.57 g/mol
Exact Mass182.99
IUPAC Name6-chloro-4-fluoroindol-2-one
SMILESO=C1C=c2c(F)cc(Cl)cc2=N1
InChIInChI=1S/C8H3ClFNO/c9-4-1-6(10)5-3-8(12)11-7(5)2-4/h1-3H
InChIKeyWPGUOQOOLZAQER-UHFFFAOYSA-N
XLogP0.42
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.57
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-chloro-4-fluoroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Indol-2-one
CID 17904787
Fluoro-indolone
CID 54356889
5-Chloroindole-2-one
CID 20284810
6-Chloroindole-2-one
CID 46739848
Cyclopenta-(b)-pyridinone
CID 129707027
3-(Trifluoromethyl)indol-2-one
CID 19417810
6-(Fluoromethyl)indol-2-one
CID 20284781
6-Fluoroindol-2-one
CID 45108281
6-(Trifluoromethyl)indol-2-one
CID 46173012
5-Fluoro-2-oxo-indole
CID 46739847
7-Fluoroindol-2-one
CID 46739858
4-Fluoro-2H-indol-2-one
CID 46739859

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-fluoroindol-2-one?
The IUPAC name of 6-chloro-4-fluoroindol-2-one (CID 171699771) is 6-chloro-4-fluoroindol-2-one.
What is the SMILES notation for 6-chloro-4-fluoroindol-2-one?
The canonical SMILES for 6-chloro-4-fluoroindol-2-one is O=C1C=c2c(F)cc(Cl)cc2=N1.
What is the InChIKey of 6-chloro-4-fluoroindol-2-one?
The InChIKey is WPGUOQOOLZAQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3ClFNO/c9-4-1-6(10)5-3-8(12)11-7(5)2-4/h1-3H.
What are the key properties of 6-chloro-4-fluoroindol-2-one?
6-chloro-4-fluoroindol-2-one has a molecular weight of 183.57 g/mol, XLogP of 0.42, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-fluoroindol-2-one is sourced from PubChem (CID 171699771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).