N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine

C15H20NO5P — CID 11278792

IUPACN-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine
SMILESCCOP(=O)(OCC)C(c1ccco1)N(O)c1ccccc1
InChIInChI=1S/C15H20NO5P/c1-3-20-22(18,21-4-2)15(14-11-8-12-19-14)16(17)13-9-6-5-7-10-13/h5-12,15,17H,3-4H2,1-2H3
InChIKeyYVHIHBIDIGGWBF-UHFFFAOYSA-N
MW325.30 g/mol
LogP4.44
Rot. Bonds8

About N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine

N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine (PubChem CID 11278792) has the molecular formula C15H20NO5P and a molecular weight of 325.30 g/mol. Its IUPAC name is N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine.

Molecular Properties

Compound NameN-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine
PubChem CID11278792
Molecular FormulaC15H20NO5P
Molecular Weight325.30 g/mol
Exact Mass325.11
IUPAC NameN-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine
SMILESCCOP(=O)(OCC)C(c1ccco1)N(O)c1ccccc1
InChIInChI=1S/C15H20NO5P/c1-3-20-22(18,21-4-2)15(14-11-8-12-19-14)16(17)13-9-6-5-7-10-13/h5-12,15,17H,3-4H2,1-2H3
InChIKeyYVHIHBIDIGGWBF-UHFFFAOYSA-N
XLogP4.44
TPSA72.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.30
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[diethoxyphosphoryl(ethoxy)methyl]furan
CID 71381055
diethyl 2-[diethoxyphosphoryl(furan-2-yl)methyl]propanedioate;hydrate
CID 52997745
(1S)-2-diethoxyphosphoryl-1-(furan-2-yl)ethanol
CID 11299626
2-diethoxyphosphoryl-1-(furan-2-yl)ethanamine
CID 72796397
2-diethoxyphosphoryl-2-hydroxy-1-phenylethanone
CID 122232536
bis(diethoxyphosphoryl)methylbenzene
CID 11132243
ethyl 2-diethoxyphosphoryl-3-(furan-2-yl)-3-oxopropanoate
CID 10591620
[diethoxyphosphoryl(phenylselanyl)methyl]selanylbenzene
CID 11059605
2-[N-[1-(furan-2-yl)propyl]anilino]acetic acid
CID 65059482
N-[(1S)-1-diethoxyphosphoryl-2-oxoethyl]benzamide
CID 40537671
[diethoxyphosphoryl(methylsulfonyl)methyl]benzene
CID 14930742
1-diethoxyphosphoryl-3-phenylprop-2-en-1-ol
CID 71366492

Frequently Asked Questions

What is the IUPAC name of N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine?
The IUPAC name of N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine (CID 11278792) is N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine.
What is the SMILES notation for N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine?
The canonical SMILES for N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine is CCOP(=O)(OCC)C(c1ccco1)N(O)c1ccccc1.
What is the InChIKey of N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine?
The InChIKey is YVHIHBIDIGGWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20NO5P/c1-3-20-22(18,21-4-2)15(14-11-8-12-19-14)16(17)13-9-6-5-7-10-13/h5-12,15,17H,3-4H2,1-2H3.
What are the key properties of N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine?
N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine has a molecular weight of 325.30 g/mol, XLogP of 4.44, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[diethoxyphosphoryl(furan-2-yl)methyl]-N-phenylhydroxylamine is sourced from PubChem (CID 11278792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).