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

C32H30N2 — CID 57238866

IUPAC1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole
SMILESC=C(C1(c2ccccc2)Cc2ccccc2N1C)C1(c2ccccc2)Cc2ccccc2N1C
InChIInChI=1S/C32H30N2/c1-24(31(27-16-6-4-7-17-27)22-25-14-10-12-20-29(25)33(31)2)32(28-18-8-5-9-19-28)23-26-15-11-13-21-30(26)34(32)3/h4-21H,1,22-23H2,2-3H3
InChIKeyAEDXYSRQUKDNRN-UHFFFAOYSA-N
MW442.61 g/mol
LogP6.72
Rot. Bonds4

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

1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole (PubChem CID 57238866) has the molecular formula C32H30N2 and a molecular weight of 442.61 g/mol. Its IUPAC name is 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole.

Molecular Properties

Compound Name1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole
PubChem CID57238866
Molecular FormulaC32H30N2
Molecular Weight442.61 g/mol
Exact Mass442.24
IUPAC Name1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole
SMILESC=C(C1(c2ccccc2)Cc2ccccc2N1C)C1(c2ccccc2)Cc2ccccc2N1C
InChIInChI=1S/C32H30N2/c1-24(31(27-16-6-4-7-17-27)22-25-14-10-12-20-29(25)33(31)2)32(28-18-8-5-9-19-28)23-26-15-11-13-21-30(26)34(32)3/h4-21H,1,22-23H2,2-3H3
InChIKeyAEDXYSRQUKDNRN-UHFFFAOYSA-N
XLogP6.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.61
LogP ≤ 56.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole?
The IUPAC name of 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole (CID 57238866) is 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole.
What is the SMILES notation for 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole?
The canonical SMILES for 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole is C=C(C1(c2ccccc2)Cc2ccccc2N1C)C1(c2ccccc2)Cc2ccccc2N1C.
What is the InChIKey of 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole?
The InChIKey is AEDXYSRQUKDNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H30N2/c1-24(31(27-16-6-4-7-17-27)22-25-14-10-12-20-29(25)33(31)2)32(28-18-8-5-9-19-28)23-26-15-11-13-21-30(26)34(32)3/h4-21H,1,22-23H2,2-3H3.
What are the key properties of 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole?
1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole has a molecular weight of 442.61 g/mol, XLogP of 6.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[1-(1-methyl-2-phenyl-3H-indol-2-yl)ethenyl]-2-phenyl-3H-indole is sourced from PubChem (CID 57238866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).