1-(1H-indol-6-ylmethyl)-7-methylindole

C18H16N2 — CID 167165150

IUPAC1-(1H-indol-6-ylmethyl)-7-methylindole
SMILESCc1cccc2ccn(Cc3ccc4cc[nH]c4c3)c12
InChIInChI=1S/C18H16N2/c1-13-3-2-4-16-8-10-20(18(13)16)12-14-5-6-15-7-9-19-17(15)11-14/h2-11,19H,12H2,1H3
InChIKeyLUBSMVGAWZGFGI-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.48
Rot. Bonds2

About 1-(1H-indol-6-ylmethyl)-7-methylindole

1-(1H-indol-6-ylmethyl)-7-methylindole (PubChem CID 167165150) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-(1H-indol-6-ylmethyl)-7-methylindole.

Molecular Properties

Compound Name1-(1H-indol-6-ylmethyl)-7-methylindole
PubChem CID167165150
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name1-(1H-indol-6-ylmethyl)-7-methylindole
SMILESCc1cccc2ccn(Cc3ccc4cc[nH]c4c3)c12
InChIInChI=1S/C18H16N2/c1-13-3-2-4-16-8-10-20(18(13)16)12-14-5-6-15-7-9-19-17(15)11-14/h2-11,19H,12H2,1H3
InChIKeyLUBSMVGAWZGFGI-UHFFFAOYSA-N
XLogP4.48
TPSA20.72 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(1H-indol-6-ylmethyl)-7-methylindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-6-ylmethyl)-7-methylindole?
The IUPAC name of 1-(1H-indol-6-ylmethyl)-7-methylindole (CID 167165150) is 1-(1H-indol-6-ylmethyl)-7-methylindole.
What is the SMILES notation for 1-(1H-indol-6-ylmethyl)-7-methylindole?
The canonical SMILES for 1-(1H-indol-6-ylmethyl)-7-methylindole is Cc1cccc2ccn(Cc3ccc4cc[nH]c4c3)c12.
What is the InChIKey of 1-(1H-indol-6-ylmethyl)-7-methylindole?
The InChIKey is LUBSMVGAWZGFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-13-3-2-4-16-8-10-20(18(13)16)12-14-5-6-15-7-9-19-17(15)11-14/h2-11,19H,12H2,1H3.
What are the key properties of 1-(1H-indol-6-ylmethyl)-7-methylindole?
1-(1H-indol-6-ylmethyl)-7-methylindole has a molecular weight of 260.34 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-6-ylmethyl)-7-methylindole is sourced from PubChem (CID 167165150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).