3-[1-(1H-indol-3-yl)propyl]-1H-indole

C19H18N2 — CID 11150029

IUPAC3-[1-(1H-indol-3-yl)propyl]-1H-indole
SMILESCCC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C19H18N2/c1-2-13(16-11-20-18-9-5-3-7-14(16)18)17-12-21-19-10-6-4-8-15(17)19/h3-13,20-21H,2H2,1H3
InChIKeyVLRKPFYDODUEOZ-UHFFFAOYSA-N
MW274.37 g/mol
LogP5.19
Rot. Bonds3

About 3-[1-(1H-indol-3-yl)propyl]-1H-indole

3-[1-(1H-indol-3-yl)propyl]-1H-indole (PubChem CID 11150029) has the molecular formula C19H18N2 and a molecular weight of 274.37 g/mol. Its IUPAC name is 3-[1-(1H-indol-3-yl)propyl]-1H-indole.

Molecular Properties

Compound Name3-[1-(1H-indol-3-yl)propyl]-1H-indole
PubChem CID11150029
Molecular FormulaC19H18N2
Molecular Weight274.37 g/mol
Exact Mass274.15
IUPAC Name3-[1-(1H-indol-3-yl)propyl]-1H-indole
SMILESCCC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C19H18N2/c1-2-13(16-11-20-18-9-5-3-7-14(16)18)17-12-21-19-10-6-4-8-15(17)19/h3-13,20-21H,2H2,1H3
InChIKeyVLRKPFYDODUEOZ-UHFFFAOYSA-N
XLogP5.19
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.37
LogP ≤ 55.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Analyze 3-[1-(1H-indol-3-yl)propyl]-1H-indole 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 3-[1-(1H-indol-3-yl)propyl]-1H-indole?
The IUPAC name of 3-[1-(1H-indol-3-yl)propyl]-1H-indole (CID 11150029) is 3-[1-(1H-indol-3-yl)propyl]-1H-indole.
What is the SMILES notation for 3-[1-(1H-indol-3-yl)propyl]-1H-indole?
The canonical SMILES for 3-[1-(1H-indol-3-yl)propyl]-1H-indole is CCC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12.
What is the InChIKey of 3-[1-(1H-indol-3-yl)propyl]-1H-indole?
The InChIKey is VLRKPFYDODUEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2/c1-2-13(16-11-20-18-9-5-3-7-14(16)18)17-12-21-19-10-6-4-8-15(17)19/h3-13,20-21H,2H2,1H3.
What are the key properties of 3-[1-(1H-indol-3-yl)propyl]-1H-indole?
3-[1-(1H-indol-3-yl)propyl]-1H-indole has a molecular weight of 274.37 g/mol, XLogP of 5.19, 3 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(1H-indol-3-yl)propyl]-1H-indole is sourced from PubChem (CID 11150029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).