7-chloro-6-fluoro-1,5-dimethylindole

C10H9ClFN — CID 129149052

IUPAC7-chloro-6-fluoro-1,5-dimethylindole
SMILESCc1cc2ccn(C)c2c(Cl)c1F
InChIInChI=1S/C10H9ClFN/c1-6-5-7-3-4-13(2)10(7)8(11)9(6)12/h3-5H,1-2H3
InChIKeyUEDBEEQJZVGHSC-UHFFFAOYSA-N
MW197.64 g/mol
LogP3.28
Rot. Bonds

About 7-chloro-6-fluoro-1,5-dimethylindole

7-chloro-6-fluoro-1,5-dimethylindole (PubChem CID 129149052) has the molecular formula C10H9ClFN and a molecular weight of 197.64 g/mol. Its IUPAC name is 7-chloro-6-fluoro-1,5-dimethylindole.

Molecular Properties

Compound Name7-chloro-6-fluoro-1,5-dimethylindole
PubChem CID129149052
Molecular FormulaC10H9ClFN
Molecular Weight197.64 g/mol
Exact Mass197.04
IUPAC Name7-chloro-6-fluoro-1,5-dimethylindole
SMILESCc1cc2ccn(C)c2c(Cl)c1F
InChIInChI=1S/C10H9ClFN/c1-6-5-7-3-4-13(2)10(7)8(11)9(6)12/h3-5H,1-2H3
InChIKeyUEDBEEQJZVGHSC-UHFFFAOYSA-N
XLogP3.28
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.64
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-fluoro-1,5-dimethylindole?
The IUPAC name of 7-chloro-6-fluoro-1,5-dimethylindole (CID 129149052) is 7-chloro-6-fluoro-1,5-dimethylindole.
What is the SMILES notation for 7-chloro-6-fluoro-1,5-dimethylindole?
The canonical SMILES for 7-chloro-6-fluoro-1,5-dimethylindole is Cc1cc2ccn(C)c2c(Cl)c1F.
What is the InChIKey of 7-chloro-6-fluoro-1,5-dimethylindole?
The InChIKey is UEDBEEQJZVGHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClFN/c1-6-5-7-3-4-13(2)10(7)8(11)9(6)12/h3-5H,1-2H3.
What are the key properties of 7-chloro-6-fluoro-1,5-dimethylindole?
7-chloro-6-fluoro-1,5-dimethylindole has a molecular weight of 197.64 g/mol, XLogP of 3.28, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-fluoro-1,5-dimethylindole is sourced from PubChem (CID 129149052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).