carbanide;gold(3+);methyl(diphenyl)phosphanium

C16H23AuP+ — CID 6327558

IUPACcarbanide;gold(3+);methyl(diphenyl)phosphanium
SMILESC[PH+](c1ccccc1)c1ccccc1.[Au+3].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C13H13P.3CH3.Au/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;;/h2-11H,1H3;3*1H3;/q;3*-1;+3/p+1
InChIKeyCAWWATNUPMLPDK-UHFFFAOYSA-O
MW443.30 g/mol
LogP3.83
Rot. Bonds2

About carbanide;gold(3+);methyl(diphenyl)phosphanium

carbanide;gold(3+);methyl(diphenyl)phosphanium (PubChem CID 6327558) has the molecular formula C16H23AuP+ and a molecular weight of 443.30 g/mol. Its IUPAC name is carbanide;gold(3+);methyl(diphenyl)phosphanium.

Molecular Properties

Compound Namecarbanide;gold(3+);methyl(diphenyl)phosphanium
PubChem CID6327558
Molecular FormulaC16H23AuP+
Molecular Weight443.30 g/mol
Exact Mass443.12
IUPAC Namecarbanide;gold(3+);methyl(diphenyl)phosphanium
SMILESC[PH+](c1ccccc1)c1ccccc1.[Au+3].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C13H13P.3CH3.Au/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;;/h2-11H,1H3;3*1H3;/q;3*-1;+3/p+1
InChIKeyCAWWATNUPMLPDK-UHFFFAOYSA-O
XLogP3.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.30
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze carbanide;gold(3+);methyl(diphenyl)phosphanium 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 carbanide;gold(3+);methyl(diphenyl)phosphanium?
The IUPAC name of carbanide;gold(3+);methyl(diphenyl)phosphanium (CID 6327558) is carbanide;gold(3+);methyl(diphenyl)phosphanium.
What is the SMILES notation for carbanide;gold(3+);methyl(diphenyl)phosphanium?
The canonical SMILES for carbanide;gold(3+);methyl(diphenyl)phosphanium is C[PH+](c1ccccc1)c1ccccc1.[Au+3].[CH3-].[CH3-].[CH3-].
What is the InChIKey of carbanide;gold(3+);methyl(diphenyl)phosphanium?
The InChIKey is CAWWATNUPMLPDK-UHFFFAOYSA-O. The full InChI is InChI=1S/C13H13P.3CH3.Au/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;;;;/h2-11H,1H3;3*1H3;/q;3*-1;+3/p+1.
What are the key properties of carbanide;gold(3+);methyl(diphenyl)phosphanium?
carbanide;gold(3+);methyl(diphenyl)phosphanium has a molecular weight of 443.30 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;gold(3+);methyl(diphenyl)phosphanium is sourced from PubChem (CID 6327558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).