Ethyl 3-amino-2-cyclohexylpropyl(diethoxymethyl)phosphinate

HCID 19379613

Substructure search Find similar structures

Basic information

Standard SMILES: CCOC(OCC)P(=O)(CC(CN)C1CCCCC1)OCC
InChIKey: XMOGZPWRXMDRKQ-UHFFFAOYSA-N
Molecular formula: C16H34NO4P
Average molar mass: 335.42 g/mol

Names & identifiers

Preferred name: Ethyl 3-amino-2-cyclohexylpropyl(diethoxymethyl)phosphinate
IUPAC: 2-cyclohexyl-3-[diethoxymethyl(ethoxy)phosphoryl]propan-1-amine

Names & synonyms

SCHEMBL9144020XMOGZPWRXMDRKQ-UHFFFAOYSA-Nethyl 3-amino-2-cyclohexylpropyl(diethoxymethyl)phosphinate

Database identifiers

PubChem CID: 19379613

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 70.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 11
Heavy atoms: 22
Formal charge: 0
Complexity: 328

Related reactions

12 records

New reaction record

HRID 5180 reaction equation

HRID 5180As reactantuspto-grants-1993_09

HRID 5183 reaction equation

HRID 5183As productuspto-grants-1993_09

HRID 542308 reaction equation

HRID 542308As reactantuspto-grants-1987_04

HRID 542310 reaction equation

HRID 542310As productuspto-grants-1987_04

HRID 622888 reaction equation

HRID 622888As reactantuspto-grants-1988_09

HRID 622891 reaction equation

HRID 622891As productuspto-grants-1988_09

HRID 1084498 reaction equation

HRID 1084498As reactantuspto-grants-1991_04

HRID 1084501 reaction equation

HRID 1084501As productuspto-grants-1991_04

Linked notes

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