4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole

C14H10Cl3N — CID 4621294

IUPAC4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1cccc(C2Cc3c(Cl)cc(Cl)cc3N2)c1
InChIInChI=1S/C14H10Cl3N/c15-9-3-1-2-8(4-9)13-7-11-12(17)5-10(16)6-14(11)18-13/h1-6,13,18H,7H2
InChIKeySHXBOGGATMPGCV-UHFFFAOYSA-N
MW298.60 g/mol
LogP5.36
Rot. Bonds1

About 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole

4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole (PubChem CID 4621294) has the molecular formula C14H10Cl3N and a molecular weight of 298.60 g/mol. Its IUPAC name is 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole
PubChem CID4621294
Molecular FormulaC14H10Cl3N
Molecular Weight298.60 g/mol
Exact Mass296.99
IUPAC Name4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole
SMILESClc1cccc(C2Cc3c(Cl)cc(Cl)cc3N2)c1
InChIInChI=1S/C14H10Cl3N/c15-9-3-1-2-8(4-9)13-7-11-12(17)5-10(16)6-14(11)18-13/h1-6,13,18H,7H2
InChIKeySHXBOGGATMPGCV-UHFFFAOYSA-N
XLogP5.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.60
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-chlorophenyl)-3,4-dihydro-2H-benzo[f]quinolin-1-one
CID 45035436
4,6-dichloro-2-(2,5-dimethylphenyl)-2,3-dihydro-1H-indole
CID 3997786
5-bromo-2-(3-chlorophenyl)-1,2,3,4-tetrahydroquinoline
CID 59009858
6,8-dichloro-2-(3-chlorophenyl)-3,4-dihydro-2H-1,4-benzoxazine
CID 107676510
4,6-dichloro-2-(2-ethoxyphenyl)-2,3-dihydro-1H-indole
CID 4030730
7-chloro-3-(3-chlorophenyl)-3,4-dihydro-2H-1,4-benzoxazine
CID 101467783
(2R)-2-(3-chlorophenyl)piperidine;hydrochloride
CID 154574647
2-(3-chlorophenyl)azepane;hydrochloride
CID 46835309
6-(3-chlorophenyl)-3-propyl-1,3-diazinane-2,4-dione
CID 10515936
2-(2,4-dichlorophenyl)-2,3-dihydro-1H-indole
CID 4019542
4-bromo-5-chloro-6-fluoro-2-phenyl-2,3-dihydro-1H-indole;methanamine
CID 156855813
(6R)-2-(3-chlorophenyl)-6-methylpiperidin-4-one
CID 70165727

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The IUPAC name of 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole (CID 4621294) is 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole is Clc1cccc(C2Cc3c(Cl)cc(Cl)cc3N2)c1.
What is the InChIKey of 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole?
The InChIKey is SHXBOGGATMPGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3N/c15-9-3-1-2-8(4-9)13-7-11-12(17)5-10(16)6-14(11)18-13/h1-6,13,18H,7H2.
What are the key properties of 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole?
4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole has a molecular weight of 298.60 g/mol, XLogP of 5.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-(3-chlorophenyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 4621294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).