O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine

C19H34NO10P — CID 15816818

IUPACO-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine
SMILESCCOP(=O)(OCC)C(ON)c1ccc(OCOCCOC)c(OCOCCOC)c1
InChIInChI=1S/C19H34NO10P/c1-5-28-31(21,29-6-2)19(30-20)16-7-8-17(26-14-24-11-9-22-3)18(13-16)27-15-25-12-10-23-4/h7-8,13,19H,5-6,9-12,14-15,20H2,1-4H3
InChIKeyIDMOQJUMDOGGBD-UHFFFAOYSA-N
MW467.45 g/mol
LogP2.84
Rot. Bonds19

About O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine

O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine (PubChem CID 15816818) has the molecular formula C19H34NO10P and a molecular weight of 467.45 g/mol. Its IUPAC name is O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine.

Molecular Properties

Compound NameO-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine
PubChem CID15816818
Molecular FormulaC19H34NO10P
Molecular Weight467.45 g/mol
Exact Mass467.19
IUPAC NameO-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine
SMILESCCOP(=O)(OCC)C(ON)c1ccc(OCOCCOC)c(OCOCCOC)c1
InChIInChI=1S/C19H34NO10P/c1-5-28-31(21,29-6-2)19(30-20)16-7-8-17(26-14-24-11-9-22-3)18(13-16)27-15-25-12-10-23-4/h7-8,13,19H,5-6,9-12,14-15,20H2,1-4H3
InChIKeyIDMOQJUMDOGGBD-UHFFFAOYSA-N
XLogP2.84
TPSA126.16 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500467.45
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine 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

(R)-diethoxyphosphoryl-(3-ethoxy-4-methoxyphenyl)methanamine
CID 171192311
(R)-diethoxyphosphoryl-(3-ethoxy-4-phenylmethoxyphenyl)methanamine
CID 171192302
5-[3,4-bis(2-methoxyethoxymethoxy)phenyl]penta-2,4-dienoic acid
CID 54184584
methyl 2-(3,4-diethoxyphenyl)propanoate
CID 55071930
ethyl (2E,4E)-5-[4-(2-methoxyethoxymethoxy)-3-methylphenyl]penta-2,4-dienoate
CID 23046186
1-(3,4-diethoxyphenyl)-3-methoxypropan-1-ol
CID 62789961
3,4-bis(2-methoxyethoxymethoxy)-N-phenylmethoxybenzamide
CID 131887821
(R)-diethoxyphosphoryl-(2-methoxy-5-propan-2-ylphenyl)methanamine
CID 171192428
4-[amino(diethoxyphosphoryl)methyl]-2-methoxyphenol
CID 102231282
(Z)-3-[3-butoxy-4-[2-[4-(2-methoxyethoxymethoxy)phenyl]ethoxy]phenyl]-2-ethoxyprop-2-enoic acid
CID 68724153
2-[1-[3-butoxy-4-[2-[3-fluoro-4-(2-methoxyethoxymethoxy)phenyl]ethoxy]phenyl]ethoxy]ethyl prop-2-enoate
CID 140552182
4-bromo-N-[(1R)-1-(3,4-diethoxyphenyl)ethyl]benzamide
CID 2450618

Frequently Asked Questions

What is the IUPAC name of O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine?
The IUPAC name of O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine (CID 15816818) is O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine.
What is the SMILES notation for O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine?
The canonical SMILES for O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine is CCOP(=O)(OCC)C(ON)c1ccc(OCOCCOC)c(OCOCCOC)c1.
What is the InChIKey of O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine?
The InChIKey is IDMOQJUMDOGGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34NO10P/c1-5-28-31(21,29-6-2)19(30-20)16-7-8-17(26-14-24-11-9-22-3)18(13-16)27-15-25-12-10-23-4/h7-8,13,19H,5-6,9-12,14-15,20H2,1-4H3.
What are the key properties of O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine?
O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine has a molecular weight of 467.45 g/mol, XLogP of 2.84, 19 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for O-[[3,4-bis(2-methoxyethoxymethoxy)phenyl]-diethoxyphosphorylmethyl]hydroxylamine is sourced from PubChem (CID 15816818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).