N-dimethoxyphosphanyl-N-ethylethanamine

C6H16NO2P — CID 3290949

IUPACN-dimethoxyphosphanyl-N-ethylethanamine
SMILESCCN(CC)P(OC)OC
InChIInChI=1S/C6H16NO2P/c1-5-7(6-2)10(8-3)9-4/h5-6H2,1-4H3
InChIKeyYMOHGAUQWRFWEI-UHFFFAOYSA-N
MW165.17 g/mol
LogP1.85
Rot. Bonds5

About N-dimethoxyphosphanyl-N-ethylethanamine

N-dimethoxyphosphanyl-N-ethylethanamine (PubChem CID 3290949) has the molecular formula C6H16NO2P and a molecular weight of 165.17 g/mol. Its IUPAC name is N-dimethoxyphosphanyl-N-ethylethanamine.

Molecular Properties

Compound NameN-dimethoxyphosphanyl-N-ethylethanamine
PubChem CID3290949
Molecular FormulaC6H16NO2P
Molecular Weight165.17 g/mol
Exact Mass165.09
IUPAC NameN-dimethoxyphosphanyl-N-ethylethanamine
SMILESCCN(CC)P(OC)OC
InChIInChI=1S/C6H16NO2P/c1-5-7(6-2)10(8-3)9-4/h5-6H2,1-4H3
InChIKeyYMOHGAUQWRFWEI-UHFFFAOYSA-N
XLogP1.85
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-dimethoxyphosphanyl-N-ethylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-dimethoxyphosphanyl-N-ethylethanamine?
The IUPAC name of N-dimethoxyphosphanyl-N-ethylethanamine (CID 3290949) is N-dimethoxyphosphanyl-N-ethylethanamine.
What is the SMILES notation for N-dimethoxyphosphanyl-N-ethylethanamine?
The canonical SMILES for N-dimethoxyphosphanyl-N-ethylethanamine is CCN(CC)P(OC)OC.
What is the InChIKey of N-dimethoxyphosphanyl-N-ethylethanamine?
The InChIKey is YMOHGAUQWRFWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16NO2P/c1-5-7(6-2)10(8-3)9-4/h5-6H2,1-4H3.
What are the key properties of N-dimethoxyphosphanyl-N-ethylethanamine?
N-dimethoxyphosphanyl-N-ethylethanamine has a molecular weight of 165.17 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethoxyphosphanyl-N-ethylethanamine is sourced from PubChem (CID 3290949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).