6-chloro-3-fluoro-2,3-dihydro-1H-indole

C8H7ClFN — CID 105435002

IUPAC6-chloro-3-fluoro-2,3-dihydro-1H-indole
SMILESFC1CNc2cc(Cl)ccc21
InChIInChI=1S/C8H7ClFN/c9-5-1-2-6-7(10)4-11-8(6)3-5/h1-3,7,11H,4H2
InChIKeyWPYCVYMFBFAJSX-UHFFFAOYSA-N
MW171.60 g/mol
LogP2.78
Rot. Bonds

About 6-chloro-3-fluoro-2,3-dihydro-1H-indole

6-chloro-3-fluoro-2,3-dihydro-1H-indole (PubChem CID 105435002) has the molecular formula C8H7ClFN and a molecular weight of 171.60 g/mol. Its IUPAC name is 6-chloro-3-fluoro-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name6-chloro-3-fluoro-2,3-dihydro-1H-indole
PubChem CID105435002
Molecular FormulaC8H7ClFN
Molecular Weight171.60 g/mol
Exact Mass171.03
IUPAC Name6-chloro-3-fluoro-2,3-dihydro-1H-indole
SMILESFC1CNc2cc(Cl)ccc21
InChIInChI=1S/C8H7ClFN/c9-5-1-2-6-7(10)4-11-8(6)3-5/h1-3,7,11H,4H2
InChIKeyWPYCVYMFBFAJSX-UHFFFAOYSA-N
XLogP2.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.60
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6-chloro-3-fluoro-2,3-dihydro-1H-indole 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

7-chloro-3-fluoro-1,2,3,4-tetrahydroquinoline
CID 84718966
6-chloro-3-piperidin-4-yl-2,3-dihydro-1H-indole
CID 105498634
7-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
CID 16744775
(2S)-2-(4-chloro-2-fluorophenyl)aziridine
CID 55264086
(4S)-4-benzyl-7-chloro-1,2,3,4-tetrahydroquinoline
CID 56590209
2-(5-chloro-2,3-dihydro-1H-indol-3-yl)acetaldehyde
CID 112711571
6-chloro-2-methyl-3,4-dihydro-2H-1,4-benzothiazine
CID 84619645
(3R)-5-chloro-3-ethyl-2,3-dihydro-1H-indole
CID 95430825
6-chloro-1-fluoro-2,3-dihydro-1H-indene
CID 84717388
3-(3-chlorophenyl)-2,3-dihydro-1H-indole
CID 18675457
2-(5-chloro-2,3-dihydro-1H-indol-3-yl)propan-2-ol
CID 117202115
7-chloro-2-(2-methylpropyl)-1,2,3,4-tetrahydroquinoxaline
CID 115472197

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-fluoro-2,3-dihydro-1H-indole?
The IUPAC name of 6-chloro-3-fluoro-2,3-dihydro-1H-indole (CID 105435002) is 6-chloro-3-fluoro-2,3-dihydro-1H-indole.
What is the SMILES notation for 6-chloro-3-fluoro-2,3-dihydro-1H-indole?
The canonical SMILES for 6-chloro-3-fluoro-2,3-dihydro-1H-indole is FC1CNc2cc(Cl)ccc21.
What is the InChIKey of 6-chloro-3-fluoro-2,3-dihydro-1H-indole?
The InChIKey is WPYCVYMFBFAJSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFN/c9-5-1-2-6-7(10)4-11-8(6)3-5/h1-3,7,11H,4H2.
What are the key properties of 6-chloro-3-fluoro-2,3-dihydro-1H-indole?
6-chloro-3-fluoro-2,3-dihydro-1H-indole has a molecular weight of 171.60 g/mol, XLogP of 2.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-fluoro-2,3-dihydro-1H-indole is sourced from PubChem (CID 105435002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).