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

C16H11Cl2NO — CID 63492171

IUPAC1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C16H11Cl2NO/c17-11-3-1-2-10(6-11)7-16(20)14-9-19-15-8-12(18)4-5-13(14)15/h1-6,8-9,19H,7H2
InChIKeyNZVBLXRXTCIREV-UHFFFAOYSA-N
MW304.18 g/mol
LogP4.90
Rot. Bonds3

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

1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone (PubChem CID 63492171) has the molecular formula C16H11Cl2NO and a molecular weight of 304.18 g/mol. Its IUPAC name is 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone.

Molecular Properties

Compound Name1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone
PubChem CID63492171
Molecular FormulaC16H11Cl2NO
Molecular Weight304.18 g/mol
Exact Mass303.02
IUPAC Name1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C16H11Cl2NO/c17-11-3-1-2-10(6-11)7-16(20)14-9-19-15-8-12(18)4-5-13(14)15/h1-6,8-9,19H,7H2
InChIKeyNZVBLXRXTCIREV-UHFFFAOYSA-N
XLogP4.90
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.18
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)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

2-(3-chlorophenyl)-1-(2,4-dichlorophenyl)ethanone
CID 63492855
1-(6-amino-1H-indol-3-yl)-2-phenylethanone
CID 57257325
6-chloro-1H-indole-3-carboxamide
CID 130666489
CID 170645729
CID 170645729
2-(3,4-dichlorophenyl)-1-(1H-indol-3-yl)ethanone
CID 63490590
(6-chloro-1H-indol-3-yl)-(furan-2-yl)methanone
CID 43463725
2-(3-fluorophenyl)-1-(1H-indol-3-yl)ethanone
CID 43339255
1-(6-chloro-1H-indol-3-yl)heptan-1-one
CID 114752147
1-(1H-indol-3-yl)-2-(3-methylphenyl)ethanone
CID 588980
1-(5-chloro-1H-indol-3-yl)-2-(4-methylphenyl)ethanone
CID 63878353
1-(6-chloro-1H-indol-3-yl)octan-1-one
CID 43341995
2-(6-chloro-1H-indol-3-yl)-2-oxoacetic acid
CID 22556709

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone?
The IUPAC name of 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone (CID 63492171) is 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone.
What is the SMILES notation for 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone?
The canonical SMILES for 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone is O=C(Cc1cccc(Cl)c1)c1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone?
The InChIKey is NZVBLXRXTCIREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2NO/c17-11-3-1-2-10(6-11)7-16(20)14-9-19-15-8-12(18)4-5-13(14)15/h1-6,8-9,19H,7H2.
What are the key properties of 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone?
1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone has a molecular weight of 304.18 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-1H-indol-3-yl)-2-(3-chlorophenyl)ethanone is sourced from PubChem (CID 63492171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).