tris(dimethylamino)-methylphosphanium

C7H21N3P+ — CID 3655482

IUPACtris(dimethylamino)-methylphosphanium
SMILESCN(C)[P+](C)(N(C)C)N(C)C
InChIInChI=1S/C7H21N3P/c1-8(2)11(7,9(3)4)10(5)6/h1-7H3/q+1
InChIKeyYLIQOKRAZRFCPF-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.06
Rot. Bonds3

About tris(dimethylamino)-methylphosphanium

tris(dimethylamino)-methylphosphanium (PubChem CID 3655482) has the molecular formula C7H21N3P+ and a molecular weight of 178.24 g/mol. Its IUPAC name is tris(dimethylamino)-methylphosphanium.

Molecular Properties

Compound Nametris(dimethylamino)-methylphosphanium
PubChem CID3655482
Molecular FormulaC7H21N3P+
Molecular Weight178.24 g/mol
Exact Mass178.15
IUPAC Nametris(dimethylamino)-methylphosphanium
SMILESCN(C)[P+](C)(N(C)C)N(C)C
InChIInChI=1S/C7H21N3P/c1-8(2)11(7,9(3)4)10(5)6/h1-7H3/q+1
InChIKeyYLIQOKRAZRFCPF-UHFFFAOYSA-N
XLogP1.06
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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)-methylphosphanium?
The IUPAC name of tris(dimethylamino)-methylphosphanium (CID 3655482) is tris(dimethylamino)-methylphosphanium.
What is the SMILES notation for tris(dimethylamino)-methylphosphanium?
The canonical SMILES for tris(dimethylamino)-methylphosphanium is CN(C)[P+](C)(N(C)C)N(C)C.
What is the InChIKey of tris(dimethylamino)-methylphosphanium?
The InChIKey is YLIQOKRAZRFCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H21N3P/c1-8(2)11(7,9(3)4)10(5)6/h1-7H3/q+1.
What are the key properties of tris(dimethylamino)-methylphosphanium?
tris(dimethylamino)-methylphosphanium has a molecular weight of 178.24 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dimethylamino)-methylphosphanium is sourced from PubChem (CID 3655482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).