methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium

C6H15NP+ — CID 91507950

IUPACmethyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium
SMILESC=[P+](C)C(C)CNC
InChIInChI=1S/C6H15NP/c1-6(5-7-2)8(3)4/h6-7H,3,5H2,1-2,4H3/q+1
InChIKeyGYJYJRLMGWCBFK-UHFFFAOYSA-N
MW132.17 g/mol
LogP1.14
Rot. Bonds3

About methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium

methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium (PubChem CID 91507950) has the molecular formula C6H15NP+ and a molecular weight of 132.17 g/mol. Its IUPAC name is methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium.

Molecular Properties

Compound Namemethyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium
PubChem CID91507950
Molecular FormulaC6H15NP+
Molecular Weight132.17 g/mol
Exact Mass132.09
IUPAC Namemethyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium
SMILESC=[P+](C)C(C)CNC
InChIInChI=1S/C6H15NP/c1-6(5-7-2)8(3)4/h6-7H,3,5H2,1-2,4H3/q+1
InChIKeyGYJYJRLMGWCBFK-UHFFFAOYSA-N
XLogP1.14
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 51.14
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 methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium?
The IUPAC name of methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium (CID 91507950) is methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium.
What is the SMILES notation for methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium?
The canonical SMILES for methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium is C=[P+](C)C(C)CNC.
What is the InChIKey of methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium?
The InChIKey is GYJYJRLMGWCBFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NP/c1-6(5-7-2)8(3)4/h6-7H,3,5H2,1-2,4H3/q+1.
What are the key properties of methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium?
methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium has a molecular weight of 132.17 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[1-(methylamino)propan-2-yl]-methylidenephosphanium is sourced from PubChem (CID 91507950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).