dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine

C7H19NOP+ — CID 91438537

IUPACdimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)C.C[P+](C)=O
InChIInChI=1S/C5H13N.C2H6OP/c1-5(2,3)6-4;1-4(2)3/h6H,1-4H3;1-2H3/q;+1
InChIKeyDPTVDDLNIXEEHU-UHFFFAOYSA-N
MW164.21 g/mol
LogP2.08
Rot. Bonds

About dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine

dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine (PubChem CID 91438537) has the molecular formula C7H19NOP+ and a molecular weight of 164.21 g/mol. Its IUPAC name is dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine.

Molecular Properties

Compound Namedimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine
PubChem CID91438537
Molecular FormulaC7H19NOP+
Molecular Weight164.21 g/mol
Exact Mass164.12
IUPAC Namedimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine
SMILESCNC(C)(C)C.C[P+](C)=O
InChIInChI=1S/C5H13N.C2H6OP/c1-5(2,3)6-4;1-4(2)3/h6H,1-4H3;1-2H3/q;+1
InChIKeyDPTVDDLNIXEEHU-UHFFFAOYSA-N
XLogP2.08
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-phosphorosopropan-2-amine
CID 20668937
1-dimethylphosphoryl-N,2-dimethylpropan-2-amine
CID 22976163
2-dimethylphosphoryl-N-methylpropan-2-amine
CID 22976169
N-(ditert-butylphosphanylmethyl)-2-methylpropan-2-amine
CID 88296467
dimethyl(oxo)phosphanium;N-methylpropan-2-amine
CID 91045104
N-(dimethylphosphorylmethyl)propan-2-amine
CID 122537109
methane;N-methyl-2-phosphorosopropan-2-amine
CID 161866675

Frequently Asked Questions

What is the IUPAC name of dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine?
The IUPAC name of dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine (CID 91438537) is dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine.
What is the SMILES notation for dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine?
The canonical SMILES for dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine is CNC(C)(C)C.C[P+](C)=O.
What is the InChIKey of dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine?
The InChIKey is DPTVDDLNIXEEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C2H6OP/c1-5(2,3)6-4;1-4(2)3/h6H,1-4H3;1-2H3/q;+1.
What are the key properties of dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine?
dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine has a molecular weight of 164.21 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl(oxo)phosphanium;N,2-dimethylpropan-2-amine is sourced from PubChem (CID 91438537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).