2-(1-ethylindol-3-yl)ethyl-diphenylphosphane

C24H24NP — CID 101444467

IUPAC2-(1-ethylindol-3-yl)ethyl-diphenylphosphane
SMILESCCn1cc(CCP(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C24H24NP/c1-2-25-19-20(23-15-9-10-16-24(23)25)17-18-26(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19H,2,17-18H2,1H3
InChIKeyBYZVKRXGAIIUMM-UHFFFAOYSA-N
MW357.44 g/mol
LogP5.34
Rot. Bonds6

About 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane

2-(1-ethylindol-3-yl)ethyl-diphenylphosphane (PubChem CID 101444467) has the molecular formula C24H24NP and a molecular weight of 357.44 g/mol. Its IUPAC name is 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane.

Molecular Properties

Compound Name2-(1-ethylindol-3-yl)ethyl-diphenylphosphane
PubChem CID101444467
Molecular FormulaC24H24NP
Molecular Weight357.44 g/mol
Exact Mass357.16
IUPAC Name2-(1-ethylindol-3-yl)ethyl-diphenylphosphane
SMILESCCn1cc(CCP(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C24H24NP/c1-2-25-19-20(23-15-9-10-16-24(23)25)17-18-26(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19H,2,17-18H2,1H3
InChIKeyBYZVKRXGAIIUMM-UHFFFAOYSA-N
XLogP5.34
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.44
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane 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 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane?
The IUPAC name of 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane (CID 101444467) is 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane.
What is the SMILES notation for 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane?
The canonical SMILES for 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane is CCn1cc(CCP(c2ccccc2)c2ccccc2)c2ccccc21.
What is the InChIKey of 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane?
The InChIKey is BYZVKRXGAIIUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24NP/c1-2-25-19-20(23-15-9-10-16-24(23)25)17-18-26(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,19H,2,17-18H2,1H3.
What are the key properties of 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane?
2-(1-ethylindol-3-yl)ethyl-diphenylphosphane has a molecular weight of 357.44 g/mol, XLogP of 5.34, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylindol-3-yl)ethyl-diphenylphosphane is sourced from PubChem (CID 101444467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).