2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone

C16H10ClF2NO — CID 43163477

IUPAC2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone
SMILESO=C(Cc1c(F)cccc1Cl)c1c[nH]c2cc(F)ccc12
InChIInChI=1S/C16H10ClF2NO/c17-13-2-1-3-14(19)11(13)7-16(21)12-8-20-15-6-9(18)4-5-10(12)15/h1-6,8,20H,7H2
InChIKeyPKRRCSFIIXHDMX-UHFFFAOYSA-N
MW305.71 g/mol
LogP4.52
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone

2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone (PubChem CID 43163477) has the molecular formula C16H10ClF2NO and a molecular weight of 305.71 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone
PubChem CID43163477
Molecular FormulaC16H10ClF2NO
Molecular Weight305.71 g/mol
Exact Mass305.04
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone
SMILESO=C(Cc1c(F)cccc1Cl)c1c[nH]c2cc(F)ccc12
InChIInChI=1S/C16H10ClF2NO/c17-13-2-1-3-14(19)11(13)7-16(21)12-8-20-15-6-9(18)4-5-10(12)15/h1-6,8,20H,7H2
InChIKeyPKRRCSFIIXHDMX-UHFFFAOYSA-N
XLogP4.52
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.71
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chloro-2-fluorophenyl)-(6-fluoro-1H-indol-3-yl)methanone
CID 81266663
2-(2-chlorophenyl)-1-(5-fluoro-1H-indol-3-yl)ethanone
CID 63841269
1-(2-chloro-4,5-difluorophenyl)-2-(2-chloro-6-fluorophenyl)ethanone
CID 107475686
N-[2-(2,4-dichlorophenyl)ethyl]-6-fluoro-1H-indole-3-carboxamide
CID 113206229
2-(2-chloro-6-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethanone
CID 82883461
2-(2,6-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanone
CID 55187917
1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone
CID 63492171
2-(2-chloro-6-fluorophenyl)-1-(1H-pyrrol-2-yl)ethanone
CID 63749070
1-(2-amino-4-chlorophenyl)-2-(2-chloro-6-fluorophenyl)ethanone
CID 64914010
2-(2-chloro-6-fluorophenyl)-1-(2,4-dihydroxyphenyl)ethanone
CID 800932
2-(2-chloro-6-fluorophenyl)-1-(2,4,6-trichlorophenyl)ethanone
CID 105349147
2-(6-fluoro-1H-indol-3-yl)-N-[2-(2-fluorophenyl)ethyl]-2-oxoacetamide
CID 113208583

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone (CID 43163477) is 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone is O=C(Cc1c(F)cccc1Cl)c1c[nH]c2cc(F)ccc12.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone?
The InChIKey is PKRRCSFIIXHDMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClF2NO/c17-13-2-1-3-14(19)11(13)7-16(21)12-8-20-15-6-9(18)4-5-10(12)15/h1-6,8,20H,7H2.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone?
2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone has a molecular weight of 305.71 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-(6-fluoro-1H-indol-3-yl)ethanone is sourced from PubChem (CID 43163477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).