[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium

C13H39N7P2+2 — CID 164764518

IUPAC[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium
SMILESCN(C)P(=N[P+](N(C)C)(N(C)C)N(C)C)(N(C)C)[N+](C)(C)C
InChIInChI=1S/C13H39N7P2/c1-15(2)21(16(3)4,17(5)6)14-22(18(7)8,19(9)10)20(11,12)13/h1-13H3/q+2
InChIKeyXUIZXSWYDVWESW-UHFFFAOYSA-N
MW355.45 g/mol
LogP2.12
Rot. Bonds7

About [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium

[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium (PubChem CID 164764518) has the molecular formula C13H39N7P2+2 and a molecular weight of 355.45 g/mol. Its IUPAC name is [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium.

Molecular Properties

Compound Name[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium
PubChem CID164764518
Molecular FormulaC13H39N7P2+2
Molecular Weight355.45 g/mol
Exact Mass355.27
IUPAC Name[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium
SMILESCN(C)P(=N[P+](N(C)C)(N(C)C)N(C)C)(N(C)C)[N+](C)(C)C
InChIInChI=1S/C13H39N7P2/c1-15(2)21(16(3)4,17(5)6)14-22(18(7)8,19(9)10)20(11,12)13/h1-13H3/q+2
InChIKeyXUIZXSWYDVWESW-UHFFFAOYSA-N
XLogP2.12
TPSA28.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.45
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium?
The IUPAC name of [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium (CID 164764518) is [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium.
What is the SMILES notation for [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium?
The canonical SMILES for [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium is CN(C)P(=N[P+](N(C)C)(N(C)C)N(C)C)(N(C)C)[N+](C)(C)C.
What is the InChIKey of [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium?
The InChIKey is XUIZXSWYDVWESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H39N7P2/c1-15(2)21(16(3)4,17(5)6)14-22(18(7)8,19(9)10)20(11,12)13/h1-13H3/q+2.
What are the key properties of [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium?
[bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium has a molecular weight of 355.45 g/mol, XLogP of 2.12, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [bis(dimethylamino)-[tris(dimethylamino)phosphaniumylimino]-λ5-phosphanyl]-trimethylazanium is sourced from PubChem (CID 164764518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).