[diethylamino(methoxy)phosphoryl] dimethyl phosphate

C7H19NO6P2 — CID 11697

IUPAC[diethylamino(methoxy)phosphoryl] dimethyl phosphate
SMILESCCN(CC)P(=O)(OC)OP(=O)(OC)OC
InChIInChI=1S/C7H19NO6P2/c1-6-8(7-2)15(9,11-3)14-16(10,12-4)13-5/h6-7H2,1-5H3
InChIKeyKWNADQGGXNRKNB-UHFFFAOYSA-N
MW275.18 g/mol
LogP2.50
Rot. Bonds8

About [diethylamino(methoxy)phosphoryl] dimethyl phosphate

[diethylamino(methoxy)phosphoryl] dimethyl phosphate (PubChem CID 11697) has the molecular formula C7H19NO6P2 and a molecular weight of 275.18 g/mol. Its IUPAC name is [diethylamino(methoxy)phosphoryl] dimethyl phosphate.

Molecular Properties

Compound Name[diethylamino(methoxy)phosphoryl] dimethyl phosphate
PubChem CID11697
Molecular FormulaC7H19NO6P2
Molecular Weight275.18 g/mol
Exact Mass275.07
IUPAC Name[diethylamino(methoxy)phosphoryl] dimethyl phosphate
SMILESCCN(CC)P(=O)(OC)OP(=O)(OC)OC
InChIInChI=1S/C7H19NO6P2/c1-6-8(7-2)15(9,11-3)14-16(10,12-4)13-5/h6-7H2,1-5H3
InChIKeyKWNADQGGXNRKNB-UHFFFAOYSA-N
XLogP2.50
TPSA74.30 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze [diethylamino(methoxy)phosphoryl] dimethyl phosphate with MolForge

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

Launch Full Analysis

Related Compounds

Dimethyl N,N-diethylphosphoramidate
CID 99582
P,P-Diamidoimidodiphosphoric acid, N''-ethyl-N,N,N',N'-tetramethyl-, diethyl ester
CID 3042455
Phosphoramidic acid, diethyl-, ethyl methyl ester
CID 15083625
Diethyl methyl diethylamidodiphosphate
CID 12236
HC 4131
CID 11227
Phosphoramidothioic acid, N,N-diethyl-, O-methyl ester, S-ester with diethyl 2-mercaptoethyl phosphoramidate
CID 3051181
N,N-diethyl phosphoramido chloridic acid methyl ester
CID 317386
Dimethyl N,N-diethylphosphoramidoite
CID 3290949
N-dimethoxyphosphoryl-N-methylethanamine
CID 86037659
Phosphorodiamidic acid, tetraethyl-, methyl ester
CID 176513
N-dimethoxyphosphoryl-N-ethylpropan-1-amine
CID 86037660
diethyl N-ethyl-N-(diethoxyphosphino)amino-methylphosphonate
CID 12030538

Frequently Asked Questions

What is the IUPAC name of [diethylamino(methoxy)phosphoryl] dimethyl phosphate?
The IUPAC name of [diethylamino(methoxy)phosphoryl] dimethyl phosphate (CID 11697) is [diethylamino(methoxy)phosphoryl] dimethyl phosphate.
What is the SMILES notation for [diethylamino(methoxy)phosphoryl] dimethyl phosphate?
The canonical SMILES for [diethylamino(methoxy)phosphoryl] dimethyl phosphate is CCN(CC)P(=O)(OC)OP(=O)(OC)OC.
What is the InChIKey of [diethylamino(methoxy)phosphoryl] dimethyl phosphate?
The InChIKey is KWNADQGGXNRKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NO6P2/c1-6-8(7-2)15(9,11-3)14-16(10,12-4)13-5/h6-7H2,1-5H3.
What are the key properties of [diethylamino(methoxy)phosphoryl] dimethyl phosphate?
[diethylamino(methoxy)phosphoryl] dimethyl phosphate has a molecular weight of 275.18 g/mol, XLogP of 2.50, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [diethylamino(methoxy)phosphoryl] dimethyl phosphate is sourced from PubChem (CID 11697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).