aminomethyl(trimethyl)phosphanium;carbanide

C5H16NP — CID 159656059

IUPACaminomethyl(trimethyl)phosphanium;carbanide
SMILESC[P+](C)(C)CN.[CH3-]
InChIInChI=1S/C4H13NP.CH3/c1-6(2,3)4-5;/h4-5H2,1-3H3;1H3/q+1;-1
InChIKeyMSEQDAIAARORJP-UHFFFAOYSA-N
MW121.16 g/mol
LogP1.26
Rot. Bonds1

About aminomethyl(trimethyl)phosphanium;carbanide

aminomethyl(trimethyl)phosphanium;carbanide (PubChem CID 159656059) has the molecular formula C5H16NP and a molecular weight of 121.16 g/mol. Its IUPAC name is aminomethyl(trimethyl)phosphanium;carbanide.

Molecular Properties

Compound Nameaminomethyl(trimethyl)phosphanium;carbanide
PubChem CID159656059
Molecular FormulaC5H16NP
Molecular Weight121.16 g/mol
Exact Mass121.10
IUPAC Nameaminomethyl(trimethyl)phosphanium;carbanide
SMILESC[P+](C)(C)CN.[CH3-]
InChIInChI=1S/C4H13NP.CH3/c1-6(2,3)4-5;/h4-5H2,1-3H3;1H3/q+1;-1
InChIKeyMSEQDAIAARORJP-UHFFFAOYSA-N
XLogP1.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.16
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of aminomethyl(trimethyl)phosphanium;carbanide?
The IUPAC name of aminomethyl(trimethyl)phosphanium;carbanide (CID 159656059) is aminomethyl(trimethyl)phosphanium;carbanide.
What is the SMILES notation for aminomethyl(trimethyl)phosphanium;carbanide?
The canonical SMILES for aminomethyl(trimethyl)phosphanium;carbanide is C[P+](C)(C)CN.[CH3-].
What is the InChIKey of aminomethyl(trimethyl)phosphanium;carbanide?
The InChIKey is MSEQDAIAARORJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13NP.CH3/c1-6(2,3)4-5;/h4-5H2,1-3H3;1H3/q+1;-1.
What are the key properties of aminomethyl(trimethyl)phosphanium;carbanide?
aminomethyl(trimethyl)phosphanium;carbanide has a molecular weight of 121.16 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aminomethyl(trimethyl)phosphanium;carbanide is sourced from PubChem (CID 159656059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).