N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine

C14H35N2O4P3 — CID 12543033

IUPACN-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine
SMILESCCOP(=O)(N(CC)CC)P(CC)P(=O)(OCC)N(CC)CC
InChIInChI=1S/C14H35N2O4P3/c1-8-15(9-2)22(17,19-12-5)21(14-7)23(18,20-13-6)16(10-3)11-4/h8-14H2,1-7H3
InChIKeyFDONLKMPCDODEK-UHFFFAOYSA-N
MW388.37 g/mol
LogP5.46
Rot. Bonds13

About N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine

N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine (PubChem CID 12543033) has the molecular formula C14H35N2O4P3 and a molecular weight of 388.37 g/mol. Its IUPAC name is N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine
PubChem CID12543033
Molecular FormulaC14H35N2O4P3
Molecular Weight388.37 g/mol
Exact Mass388.18
IUPAC NameN-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine
SMILESCCOP(=O)(N(CC)CC)P(CC)P(=O)(OCC)N(CC)CC
InChIInChI=1S/C14H35N2O4P3/c1-8-15(9-2)22(17,19-12-5)21(14-7)23(18,20-13-6)16(10-3)11-4/h8-14H2,1-7H3
InChIKeyFDONLKMPCDODEK-UHFFFAOYSA-N
XLogP5.46
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.37
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-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-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine?
The IUPAC name of N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine (CID 12543033) is N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine.
What is the SMILES notation for N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine?
The canonical SMILES for N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine is CCOP(=O)(N(CC)CC)P(CC)P(=O)(OCC)N(CC)CC.
What is the InChIKey of N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine?
The InChIKey is FDONLKMPCDODEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H35N2O4P3/c1-8-15(9-2)22(17,19-12-5)21(14-7)23(18,20-13-6)16(10-3)11-4/h8-14H2,1-7H3.
What are the key properties of N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine?
N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine has a molecular weight of 388.37 g/mol, XLogP of 5.46, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[[diethylamino(ethoxy)phosphoryl]-ethylphosphanyl]-ethoxyphosphoryl]-N-ethylethanamine is sourced from PubChem (CID 12543033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).