4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine

C16H14NO2P — CID 2347629

IUPAC4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine
SMILESNP1(=O)C=C(c2ccccc2)OC(c2ccccc2)=C1
InChIInChI=1S/C16H14NO2P/c17-20(18)11-15(13-7-3-1-4-8-13)19-16(12-20)14-9-5-2-6-10-14/h1-12H,(H2,17,18)
InChIKeyHWQKMUNVYNMCQY-UHFFFAOYSA-N
MW283.27 g/mol
LogP4.25
Rot. Bonds2

About 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine

4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine (PubChem CID 2347629) has the molecular formula C16H14NO2P and a molecular weight of 283.27 g/mol. Its IUPAC name is 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine.

Molecular Properties

Compound Name4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine
PubChem CID2347629
Molecular FormulaC16H14NO2P
Molecular Weight283.27 g/mol
Exact Mass283.08
IUPAC Name4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine
SMILESNP1(=O)C=C(c2ccccc2)OC(c2ccccc2)=C1
InChIInChI=1S/C16H14NO2P/c17-20(18)11-15(13-7-3-1-4-8-13)19-16(12-20)14-9-5-2-6-10-14/h1-12H,(H2,17,18)
InChIKeyHWQKMUNVYNMCQY-UHFFFAOYSA-N
XLogP4.25
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.27
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Oxo-2,6-diphenyl-4H-4lambda*5*-[1,4]oxaphosphinin-4-ol
CID 2322533
4-Methyl-2,6-bis[4-(trifluoromethyl)phenyl]-1,4lambda5-oxaphosphinine 4-oxide
CID 164685113
2,6-Bis(4-fluorophenyl)-4-methyl-1,4lambda5-oxaphosphinine 4-oxide
CID 164686719
2-[(4-Oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-yl)amino]ethanol
CID 2307049
2-Phenyl-10,20-dioxa-13,17-diselena-2lambda5-phosphatricyclo[20.4.0.03,8]hexacosa-1(26),3,5,7,22,24-hexaene 2-oxide
CID 10841164
2,7-Diphenyloxepine
CID 13623511
2,5-Dimethyl-3,6-diphenyl-1,4-dioxine
CID 86144116
2,6-Diphenyl-4H-pyran
CID 15620364
2,3-Diphenyl-1,4-dioxine
CID 67147273
[2-(Methoxymethyl)phenyl](diphenyl)phosphine oxide
CID 2828373
4-diphenylphosphoryl-2,6-diphenyl-4H-pyran
CID 2751489
4-Cyclohepta-2,4,6-trien-1-ylidene-2,6-diphenylpyran
CID 12370077

Frequently Asked Questions

What is the IUPAC name of 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine?
The IUPAC name of 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine (CID 2347629) is 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine.
What is the SMILES notation for 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine?
The canonical SMILES for 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine is NP1(=O)C=C(c2ccccc2)OC(c2ccccc2)=C1.
What is the InChIKey of 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine?
The InChIKey is HWQKMUNVYNMCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14NO2P/c17-20(18)11-15(13-7-3-1-4-8-13)19-16(12-20)14-9-5-2-6-10-14/h1-12H,(H2,17,18).
What are the key properties of 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine?
4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine has a molecular weight of 283.27 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-2,6-diphenyl-1,4lambda5-oxaphosphinin-4-amine is sourced from PubChem (CID 2347629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).