bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium

C12H38N8P3+ — CID 155716404

IUPACbis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
SMILESCN(C)P(=N[PH2+]N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C12H37N8P3/c1-15(2)22(16(3)4,17(5)6)13-21-14-23(18(7)8,19(9)10)20(11)12/h21H,1-12H3/p+1
InChIKeyWIEXIJWCDALSOU-UHFFFAOYSA-O
MW387.41 g/mol
LogP2.49
Rot. Bonds8

About bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium

bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium (PubChem CID 155716404) has the molecular formula C12H38N8P3+ and a molecular weight of 387.41 g/mol. Its IUPAC name is bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium.

Molecular Properties

Compound Namebis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
PubChem CID155716404
Molecular FormulaC12H38N8P3+
Molecular Weight387.41 g/mol
Exact Mass387.24
IUPAC Namebis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
SMILESCN(C)P(=N[PH2+]N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C12H37N8P3/c1-15(2)22(16(3)4,17(5)6)13-21-14-23(18(7)8,19(9)10)20(11)12/h21H,1-12H3/p+1
InChIKeyWIEXIJWCDALSOU-UHFFFAOYSA-O
XLogP2.49
TPSA44.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.41
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The IUPAC name of bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium (CID 155716404) is bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium.
What is the SMILES notation for bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The canonical SMILES for bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium is CN(C)P(=N[PH2+]N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C.
What is the InChIKey of bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The InChIKey is WIEXIJWCDALSOU-UHFFFAOYSA-O. The full InChI is InChI=1S/C12H37N8P3/c1-15(2)22(16(3)4,17(5)6)13-21-14-23(18(7)8,19(9)10)20(11)12/h21H,1-12H3/p+1.
What are the key properties of bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium has a molecular weight of 387.41 g/mol, XLogP of 2.49, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium is sourced from PubChem (CID 155716404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).