[4-(3H-indol-6-yl)phenyl]phosphane

C14H12NP — CID 166650747

IUPAC[4-(3H-indol-6-yl)phenyl]phosphane
SMILESPc1ccc(-c2ccc3c(c2)N=CC3)cc1
InChIInChI=1S/C14H12NP/c16-13-5-3-10(4-6-13)12-2-1-11-7-8-15-14(11)9-12/h1-6,8-9H,7,16H2
InChIKeyGSPAZXMYKURCLL-UHFFFAOYSA-N
MW225.23 g/mol
LogP3.11
Rot. Bonds1

About [4-(3H-indol-6-yl)phenyl]phosphane

[4-(3H-indol-6-yl)phenyl]phosphane (PubChem CID 166650747) has the molecular formula C14H12NP and a molecular weight of 225.23 g/mol. Its IUPAC name is [4-(3H-indol-6-yl)phenyl]phosphane.

Molecular Properties

Compound Name[4-(3H-indol-6-yl)phenyl]phosphane
PubChem CID166650747
Molecular FormulaC14H12NP
Molecular Weight225.23 g/mol
Exact Mass225.07
IUPAC Name[4-(3H-indol-6-yl)phenyl]phosphane
SMILESPc1ccc(-c2ccc3c(c2)N=CC3)cc1
InChIInChI=1S/C14H12NP/c16-13-5-3-10(4-6-13)12-2-1-11-7-8-15-14(11)9-12/h1-6,8-9H,7,16H2
InChIKeyGSPAZXMYKURCLL-UHFFFAOYSA-N
XLogP3.11
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.23
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [4-(3H-indol-6-yl)phenyl]phosphane 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 [4-(3H-indol-6-yl)phenyl]phosphane?
The IUPAC name of [4-(3H-indol-6-yl)phenyl]phosphane (CID 166650747) is [4-(3H-indol-6-yl)phenyl]phosphane.
What is the SMILES notation for [4-(3H-indol-6-yl)phenyl]phosphane?
The canonical SMILES for [4-(3H-indol-6-yl)phenyl]phosphane is Pc1ccc(-c2ccc3c(c2)N=CC3)cc1.
What is the InChIKey of [4-(3H-indol-6-yl)phenyl]phosphane?
The InChIKey is GSPAZXMYKURCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12NP/c16-13-5-3-10(4-6-13)12-2-1-11-7-8-15-14(11)9-12/h1-6,8-9H,7,16H2.
What are the key properties of [4-(3H-indol-6-yl)phenyl]phosphane?
[4-(3H-indol-6-yl)phenyl]phosphane has a molecular weight of 225.23 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3H-indol-6-yl)phenyl]phosphane is sourced from PubChem (CID 166650747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).