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

C6H21N4P2+ — CID 21265058

IUPAC[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
SMILESCN(C)P(=N[PH3+])(N(C)C)N(C)C
InChIInChI=1S/C6H20N4P2/c1-8(2)12(7-11,9(3)4)10(5)6/h11H2,1-6H3/p+1
InChIKeyMTTIBZPCFOKBRO-UHFFFAOYSA-O
MW211.21 g/mol
LogP1.14
Rot. Bonds3

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

[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium (PubChem CID 21265058) has the molecular formula C6H21N4P2+ and a molecular weight of 211.21 g/mol. Its IUPAC name is [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium.

Molecular Properties

Compound Name[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
PubChem CID21265058
Molecular FormulaC6H21N4P2+
Molecular Weight211.21 g/mol
Exact Mass211.12
IUPAC Name[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium
SMILESCN(C)P(=N[PH3+])(N(C)C)N(C)C
InChIInChI=1S/C6H20N4P2/c1-8(2)12(7-11,9(3)4)10(5)6/h11H2,1-6H3/p+1
InChIKeyMTTIBZPCFOKBRO-UHFFFAOYSA-O
XLogP1.14
TPSA22.08 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.21
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The IUPAC name of [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium (CID 21265058) is [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium.
What is the SMILES notation for [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The canonical SMILES for [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium is CN(C)P(=N[PH3+])(N(C)C)N(C)C.
What is the InChIKey of [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
The InChIKey is MTTIBZPCFOKBRO-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H20N4P2/c1-8(2)12(7-11,9(3)4)10(5)6/h11H2,1-6H3/p+1.
What are the key properties of [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium?
[[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium has a molecular weight of 211.21 g/mol, XLogP of 1.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [[tris(dimethylamino)-λ5-phosphanylidene]amino]phosphanium is sourced from PubChem (CID 21265058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).