7-chloro-5-fluoroindol-3-one

C8H3ClFNO — CID 175052618

IUPAC7-chloro-5-fluoroindol-3-one
SMILESO=C1C=Nc2c(Cl)cc(F)cc21
InChIInChI=1S/C8H3ClFNO/c9-6-2-4(10)1-5-7(12)3-11-8(5)6/h1-3H
InChIKeyALOZFQXUUKUQDP-UHFFFAOYSA-N
MW183.57 g/mol
LogP2.38
Rot. Bonds

About 7-chloro-5-fluoroindol-3-one

7-chloro-5-fluoroindol-3-one (PubChem CID 175052618) has the molecular formula C8H3ClFNO and a molecular weight of 183.57 g/mol. Its IUPAC name is 7-chloro-5-fluoroindol-3-one.

Molecular Properties

Compound Name7-chloro-5-fluoroindol-3-one
PubChem CID175052618
Molecular FormulaC8H3ClFNO
Molecular Weight183.57 g/mol
Exact Mass182.99
IUPAC Name7-chloro-5-fluoroindol-3-one
SMILESO=C1C=Nc2c(Cl)cc(F)cc21
InChIInChI=1S/C8H3ClFNO/c9-6-2-4(10)1-5-7(12)3-11-8(5)6/h1-3H
InChIKeyALOZFQXUUKUQDP-UHFFFAOYSA-N
XLogP2.38
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.57
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-fluoroindol-3-one?
The IUPAC name of 7-chloro-5-fluoroindol-3-one (CID 175052618) is 7-chloro-5-fluoroindol-3-one.
What is the SMILES notation for 7-chloro-5-fluoroindol-3-one?
The canonical SMILES for 7-chloro-5-fluoroindol-3-one is O=C1C=Nc2c(Cl)cc(F)cc21.
What is the InChIKey of 7-chloro-5-fluoroindol-3-one?
The InChIKey is ALOZFQXUUKUQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3ClFNO/c9-6-2-4(10)1-5-7(12)3-11-8(5)6/h1-3H.
What are the key properties of 7-chloro-5-fluoroindol-3-one?
7-chloro-5-fluoroindol-3-one has a molecular weight of 183.57 g/mol, XLogP of 2.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-fluoroindol-3-one is sourced from PubChem (CID 175052618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).