diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane

C24H24NOP — CID 59017656

IUPACdiphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane
SMILESCCC[C@@H]1COC(c2ccccc2P(c2ccccc2)c2ccccc2)=N1
InChIInChI=1S/C24H24NOP/c1-2-11-19-18-26-24(25-19)22-16-9-10-17-23(22)27(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-10,12-17,19H,2,11,18H2,1H3/t19-/m1/s1
InChIKeyZLWXKFJGYPTPOD-LJQANCHMSA-N
MW373.44 g/mol
LogP4.39
Rot. Bonds6

About diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane

diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane (PubChem CID 59017656) has the molecular formula C24H24NOP and a molecular weight of 373.44 g/mol. Its IUPAC name is diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane.

Molecular Properties

Compound Namediphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane
PubChem CID59017656
Molecular FormulaC24H24NOP
Molecular Weight373.44 g/mol
Exact Mass373.16
IUPAC Namediphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane
SMILESCCC[C@@H]1COC(c2ccccc2P(c2ccccc2)c2ccccc2)=N1
InChIInChI=1S/C24H24NOP/c1-2-11-19-18-26-24(25-19)22-16-9-10-17-23(22)27(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-10,12-17,19H,2,11,18H2,1H3/t19-/m1/s1
InChIKeyZLWXKFJGYPTPOD-LJQANCHMSA-N
XLogP4.39
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.44
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Phenyl-2-oxazoline
CID 244030
(4S)-2-(3-methylphenyl)-4-(2-methylpropyl)-4,5-dihydro-1,3-oxazole
CID 17756809
2,4-Diphenyl-1,3-oxazoline
CID 10889524
(4R)-2-(2-(Diphenylphosphanyl)phenyl)-4-(propan-2-yl)-4,5-dihydro-1,3-oxazole
CID 2734144
(S)-t-BuPHOX
CID 9937955
(4S)-2-(2-(Diphenylphosphanyl)phenyl)-5,5-dimethyl-4-(propan-2-yl)-4,5-dihydro-1,3-oxazole
CID 71310816
2-(3-Methylphenyl)-4-phenyl-4,5-dihydro-1,3-oxazole
CID 9547842
(5R)-2,5-diphenyl-4,5-dihydro-1,3-oxazole
CID 10911168
(4S)-4-benzyl-2-(3-methylphenyl)-4,5-dihydro-1,3-oxazole
CID 17756895
4-Phenyl-2-(o-tolyl)-4,5-dihydrooxazole
CID 14853170
(4R)-4,5-Dihydro-2-(4-methylphenyl)-4-phenyloxazole
CID 44414834
(4S)-2-(2-(Diphenylphosphino)phenyl)-4-isopropyl-1,3-oxazoline
CID 9807779

Frequently Asked Questions

What is the IUPAC name of diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane?
The IUPAC name of diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane (CID 59017656) is diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane.
What is the SMILES notation for diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane?
The canonical SMILES for diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane is CCC[C@@H]1COC(c2ccccc2P(c2ccccc2)c2ccccc2)=N1.
What is the InChIKey of diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane?
The InChIKey is ZLWXKFJGYPTPOD-LJQANCHMSA-N. The full InChI is InChI=1S/C24H24NOP/c1-2-11-19-18-26-24(25-19)22-16-9-10-17-23(22)27(20-12-5-3-6-13-20)21-14-7-4-8-15-21/h3-10,12-17,19H,2,11,18H2,1H3/t19-/m1/s1.
What are the key properties of diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane?
diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane has a molecular weight of 373.44 g/mol, XLogP of 4.39, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[2-[(4R)-4-propyl-4,5-dihydro-1,3-oxazol-2-yl]phenyl]phosphane is sourced from PubChem (CID 59017656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).