aminomethyl(trimethyl)phosphanium

C4H13NP+ — CID 59031794

IUPACaminomethyl(trimethyl)phosphanium
SMILESC[P+](C)(C)CN
InChIInChI=1S/C4H13NP/c1-6(2,3)4-5/h4-5H2,1-3H3/q+1
InChIKeyQCXVJCGMOZCBFX-UHFFFAOYSA-N
MW106.13 g/mol
LogP0.81
Rot. Bonds1

About aminomethyl(trimethyl)phosphanium

aminomethyl(trimethyl)phosphanium (PubChem CID 59031794) has the molecular formula C4H13NP+ and a molecular weight of 106.13 g/mol. Its IUPAC name is aminomethyl(trimethyl)phosphanium.

Molecular Properties

Compound Nameaminomethyl(trimethyl)phosphanium
PubChem CID59031794
Molecular FormulaC4H13NP+
Molecular Weight106.13 g/mol
Exact Mass106.08
IUPAC Nameaminomethyl(trimethyl)phosphanium
SMILESC[P+](C)(C)CN
InChIInChI=1S/C4H13NP/c1-6(2,3)4-5/h4-5H2,1-3H3/q+1
InChIKeyQCXVJCGMOZCBFX-UHFFFAOYSA-N
XLogP0.81
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.13
LogP ≤ 50.81
H-Bond Donors ≤ 51
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 aminomethyl(trimethyl)phosphanium?
The IUPAC name of aminomethyl(trimethyl)phosphanium (CID 59031794) is aminomethyl(trimethyl)phosphanium.
What is the SMILES notation for aminomethyl(trimethyl)phosphanium?
The canonical SMILES for aminomethyl(trimethyl)phosphanium is C[P+](C)(C)CN.
What is the InChIKey of aminomethyl(trimethyl)phosphanium?
The InChIKey is QCXVJCGMOZCBFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13NP/c1-6(2,3)4-5/h4-5H2,1-3H3/q+1.
What are the key properties of aminomethyl(trimethyl)phosphanium?
aminomethyl(trimethyl)phosphanium has a molecular weight of 106.13 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aminomethyl(trimethyl)phosphanium is sourced from PubChem (CID 59031794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).