tris(dimethylamino)-propan-2-ylphosphanium

C9H25N3P+ — CID 10782850

IUPACtris(dimethylamino)-propan-2-ylphosphanium
SMILESCC(C)[P+](N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C9H25N3P/c1-9(2)13(10(3)4,11(5)6)12(7)8/h9H,1-8H3/q+1
InChIKeyQGLWRZVDYJWOGW-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.84
Rot. Bonds4

About tris(dimethylamino)-propan-2-ylphosphanium

tris(dimethylamino)-propan-2-ylphosphanium (PubChem CID 10782850) has the molecular formula C9H25N3P+ and a molecular weight of 206.29 g/mol. Its IUPAC name is tris(dimethylamino)-propan-2-ylphosphanium.

Molecular Properties

Compound Nametris(dimethylamino)-propan-2-ylphosphanium
PubChem CID10782850
Molecular FormulaC9H25N3P+
Molecular Weight206.29 g/mol
Exact Mass206.18
IUPAC Nametris(dimethylamino)-propan-2-ylphosphanium
SMILESCC(C)[P+](N(C)C)(N(C)C)N(C)C
InChIInChI=1S/C9H25N3P/c1-9(2)13(10(3)4,11(5)6)12(7)8/h9H,1-8H3/q+1
InChIKeyQGLWRZVDYJWOGW-UHFFFAOYSA-N
XLogP1.84
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.84
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)-propan-2-ylphosphanium?
The IUPAC name of tris(dimethylamino)-propan-2-ylphosphanium (CID 10782850) is tris(dimethylamino)-propan-2-ylphosphanium.
What is the SMILES notation for tris(dimethylamino)-propan-2-ylphosphanium?
The canonical SMILES for tris(dimethylamino)-propan-2-ylphosphanium is CC(C)[P+](N(C)C)(N(C)C)N(C)C.
What is the InChIKey of tris(dimethylamino)-propan-2-ylphosphanium?
The InChIKey is QGLWRZVDYJWOGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H25N3P/c1-9(2)13(10(3)4,11(5)6)12(7)8/h9H,1-8H3/q+1.
What are the key properties of tris(dimethylamino)-propan-2-ylphosphanium?
tris(dimethylamino)-propan-2-ylphosphanium has a molecular weight of 206.29 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dimethylamino)-propan-2-ylphosphanium is sourced from PubChem (CID 10782850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).