2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone

C16H10Cl2FNO — CID 103427998

IUPAC2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone
SMILESO=C(Cn1ccc2c(Cl)cc(Cl)cc21)c1ccccc1F
InChIInChI=1S/C16H10Cl2FNO/c17-10-7-13(18)11-5-6-20(15(11)8-10)9-16(21)12-3-1-2-4-14(12)19/h1-8H,9H2
InChIKeyGBXJXQFOWZXNJP-UHFFFAOYSA-N
MW322.17 g/mol
LogP4.97
Rot. Bonds3

About 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone

2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone (PubChem CID 103427998) has the molecular formula C16H10Cl2FNO and a molecular weight of 322.17 g/mol. Its IUPAC name is 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone.

Molecular Properties

Compound Name2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone
PubChem CID103427998
Molecular FormulaC16H10Cl2FNO
Molecular Weight322.17 g/mol
Exact Mass321.01
IUPAC Name2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone
SMILESO=C(Cn1ccc2c(Cl)cc(Cl)cc21)c1ccccc1F
InChIInChI=1S/C16H10Cl2FNO/c17-10-7-13(18)11-5-6-20(15(11)8-10)9-16(21)12-3-1-2-4-14(12)19/h1-8H,9H2
InChIKeyGBXJXQFOWZXNJP-UHFFFAOYSA-N
XLogP4.97
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.17
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone 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

1-(3-bromophenyl)-2-(4,6-dichloroindol-1-yl)ethanone
CID 103427977
2-(4,6-dichloroindol-1-yl)-1-(1-methylpyrrol-3-yl)ethanone
CID 103427962
2-(4,6-dichloroindol-1-yl)-N,N-dimethylacetamide
CID 103428458
1-(2-fluorophenyl)-2-(6-methylindol-1-yl)ethanone
CID 62025038
4,6-dichloro-1-[(2,3-difluorophenyl)methyl]indole
CID 103428267
2-(4,6-dichloroindol-1-yl)-N-ethyl-N-methylacetamide
CID 103428284
4,6-dichloro-1-[(E)-2,3-dichloroprop-2-enyl]indole
CID 103428376
1-(3-chlorophenyl)-2-(4-fluoroindol-1-yl)ethanone
CID 82791619
2-(6-chloroindol-1-yl)-1-(2-methylphenyl)ethanone
CID 62024325
5-chloro-1-[2-(2-fluorophenyl)-2-oxoethyl]pyrimidine-2,4-dione
CID 66423572
N-[2-(4,6-dichloroindol-1-yl)ethyl]aniline
CID 103428075
4,6-dichloro-1-[(2,6-dichlorophenyl)methyl]indole
CID 103428456

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone?
The IUPAC name of 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone (CID 103427998) is 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone.
What is the SMILES notation for 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone?
The canonical SMILES for 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone is O=C(Cn1ccc2c(Cl)cc(Cl)cc21)c1ccccc1F.
What is the InChIKey of 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone?
The InChIKey is GBXJXQFOWZXNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2FNO/c17-10-7-13(18)11-5-6-20(15(11)8-10)9-16(21)12-3-1-2-4-14(12)19/h1-8H,9H2.
What are the key properties of 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone?
2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone has a molecular weight of 322.17 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dichloroindol-1-yl)-1-(2-fluorophenyl)ethanone is sourced from PubChem (CID 103427998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).