2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole

C32H26N2O2 — CID 54581544

IUPAC2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole
SMILESC=C(c1c(-c2ccccc2OC)[nH]c2ccccc12)c1c(-c2ccccc2OC)[nH]c2ccccc12
InChIInChI=1S/C32H26N2O2/c1-20(29-21-12-4-8-16-25(21)33-31(29)23-14-6-10-18-27(23)35-2)30-22-13-5-9-17-26(22)34-32(30)24-15-7-11-19-28(24)36-3/h4-19,33-34H,1H2,2-3H3
InChIKeyGRASHLGXSNAUAU-UHFFFAOYSA-N
MW470.57 g/mol
LogP8.06
Rot. Bonds6

About 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole

2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole (PubChem CID 54581544) has the molecular formula C32H26N2O2 and a molecular weight of 470.57 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole
PubChem CID54581544
Molecular FormulaC32H26N2O2
Molecular Weight470.57 g/mol
Exact Mass470.20
IUPAC Name2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole
SMILESC=C(c1c(-c2ccccc2OC)[nH]c2ccccc12)c1c(-c2ccccc2OC)[nH]c2ccccc12
InChIInChI=1S/C32H26N2O2/c1-20(29-21-12-4-8-16-25(21)33-31(29)23-14-6-10-18-27(23)35-2)30-22-13-5-9-17-26(22)34-32(30)24-15-7-11-19-28(24)36-3/h4-19,33-34H,1H2,2-3H3
InChIKeyGRASHLGXSNAUAU-UHFFFAOYSA-N
XLogP8.06
TPSA50.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.57
LogP ≤ 58.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole?
The IUPAC name of 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole (CID 54581544) is 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole.
What is the SMILES notation for 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole?
The canonical SMILES for 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole is C=C(c1c(-c2ccccc2OC)[nH]c2ccccc12)c1c(-c2ccccc2OC)[nH]c2ccccc12.
What is the InChIKey of 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole?
The InChIKey is GRASHLGXSNAUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26N2O2/c1-20(29-21-12-4-8-16-25(21)33-31(29)23-14-6-10-18-27(23)35-2)30-22-13-5-9-17-26(22)34-32(30)24-15-7-11-19-28(24)36-3/h4-19,33-34H,1H2,2-3H3.
What are the key properties of 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole?
2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole has a molecular weight of 470.57 g/mol, XLogP of 8.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-3-[1-[2-(2-methoxyphenyl)-1H-indol-3-yl]ethenyl]-1H-indole is sourced from PubChem (CID 54581544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).