7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole

C18H14Cl2N2 — CID 102233204

IUPAC7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole
SMILESCC(c1c[nH]c2c(Cl)cccc12)c1c[nH]c2c(Cl)cccc12
InChIInChI=1S/C18H14Cl2N2/c1-10(13-8-21-17-11(13)4-2-6-15(17)19)14-9-22-18-12(14)5-3-7-16(18)20/h2-10,21-22H,1H3
InChIKeyBSQJPLSMLZDOCG-UHFFFAOYSA-N
MW329.23 g/mol
LogP6.11
Rot. Bonds2

About 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole

7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole (PubChem CID 102233204) has the molecular formula C18H14Cl2N2 and a molecular weight of 329.23 g/mol. Its IUPAC name is 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole.

Molecular Properties

Compound Name7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole
PubChem CID102233204
Molecular FormulaC18H14Cl2N2
Molecular Weight329.23 g/mol
Exact Mass328.05
IUPAC Name7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole
SMILESCC(c1c[nH]c2c(Cl)cccc12)c1c[nH]c2c(Cl)cccc12
InChIInChI=1S/C18H14Cl2N2/c1-10(13-8-21-17-11(13)4-2-6-15(17)19)14-9-22-18-12(14)5-3-7-16(18)20/h2-10,21-22H,1H3
InChIKeyBSQJPLSMLZDOCG-UHFFFAOYSA-N
XLogP6.11
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.23
LogP ≤ 56.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

7-chloro-3-(2-methylpentan-3-yl)-1H-indole
CID 106985200
1-(7-chloro-1H-indol-3-yl)propan-1-amine
CID 76846666
7-chloro-3-[(E)-4-phenylbut-3-en-2-yl]-1H-indole
CID 122373983
ethyl 2-(7-chloro-1H-indol-3-yl)-2-hydroxyacetate
CID 115073313
3-bromo-7-chloro-1H-indole
CID 2763282
7-bromo-3-propan-2-yl-1H-indole
CID 106985591
7-chloro-3-methoxy-1H-indole
CID 119084271
2-(7-chloro-1H-indol-3-yl)acetonitrile
CID 10559597
7-fluoro-3-propan-2-yl-1H-indole
CID 86276645
7-bromo-3-(2-methylpentan-3-yl)-1H-indole
CID 106985203
2-(7-bromo-1H-indol-3-yl)propan-1-amine
CID 76846624
2-(3-chloro-1H-indol-7-yl)propan-1-amine
CID 117298104

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole?
The IUPAC name of 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole (CID 102233204) is 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole.
What is the SMILES notation for 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole?
The canonical SMILES for 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole is CC(c1c[nH]c2c(Cl)cccc12)c1c[nH]c2c(Cl)cccc12.
What is the InChIKey of 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole?
The InChIKey is BSQJPLSMLZDOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2/c1-10(13-8-21-17-11(13)4-2-6-15(17)19)14-9-22-18-12(14)5-3-7-16(18)20/h2-10,21-22H,1H3.
What are the key properties of 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole?
7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole has a molecular weight of 329.23 g/mol, XLogP of 6.11, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-[1-(7-chloro-1H-indol-3-yl)ethyl]-1H-indole is sourced from PubChem (CID 102233204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).