4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane

C15H14NOP — CID 54273674

IUPAC4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane
SMILESc1ccc(P(C2=NCCO2)c2ccccc2)cc1
InChIInChI=1S/C15H14NOP/c1-3-7-13(8-4-1)18(15-16-11-12-17-15)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyRLXFXDVIZUGLSE-UHFFFAOYSA-N
MW255.26 g/mol
LogP2.51
Rot. Bonds3

About 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane

4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane (PubChem CID 54273674) has the molecular formula C15H14NOP and a molecular weight of 255.26 g/mol. Its IUPAC name is 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane.

Molecular Properties

Compound Name4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane
PubChem CID54273674
Molecular FormulaC15H14NOP
Molecular Weight255.26 g/mol
Exact Mass255.08
IUPAC Name4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane
SMILESc1ccc(P(C2=NCCO2)c2ccccc2)cc1
InChIInChI=1S/C15H14NOP/c1-3-7-13(8-4-1)18(15-16-11-12-17-15)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyRLXFXDVIZUGLSE-UHFFFAOYSA-N
XLogP2.51
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.26
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane?
The IUPAC name of 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane (CID 54273674) is 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane.
What is the SMILES notation for 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane?
The canonical SMILES for 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane is c1ccc(P(C2=NCCO2)c2ccccc2)cc1.
What is the InChIKey of 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane?
The InChIKey is RLXFXDVIZUGLSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14NOP/c1-3-7-13(8-4-1)18(15-16-11-12-17-15)14-9-5-2-6-10-14/h1-10H,11-12H2.
What are the key properties of 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane?
4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane has a molecular weight of 255.26 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-oxazol-2-yl(diphenyl)phosphane is sourced from PubChem (CID 54273674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).