5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol

C19H19NO2 — CID 59857619

IUPAC5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol
SMILESCc1ccc(C2=NOC(O)(C3CC3)C2c2ccccc2)cc1
InChIInChI=1S/C19H19NO2/c1-13-7-9-15(10-8-13)18-17(14-5-3-2-4-6-14)19(21,22-20-18)16-11-12-16/h2-10,16-17,21H,11-12H2,1H3
InChIKeyLRZZODSYSQDEKD-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.61
Rot. Bonds3

About 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol

5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol (PubChem CID 59857619) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol.

Molecular Properties

Compound Name5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol
PubChem CID59857619
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol
SMILESCc1ccc(C2=NOC(O)(C3CC3)C2c2ccccc2)cc1
InChIInChI=1S/C19H19NO2/c1-13-7-9-15(10-8-13)18-17(14-5-3-2-4-6-14)19(21,22-20-18)16-11-12-16/h2-10,16-17,21H,11-12H2,1H3
InChIKeyLRZZODSYSQDEKD-UHFFFAOYSA-N
XLogP3.61
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol?
The IUPAC name of 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol (CID 59857619) is 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol.
What is the SMILES notation for 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol?
The canonical SMILES for 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol is Cc1ccc(C2=NOC(O)(C3CC3)C2c2ccccc2)cc1.
What is the InChIKey of 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol?
The InChIKey is LRZZODSYSQDEKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c1-13-7-9-15(10-8-13)18-17(14-5-3-2-4-6-14)19(21,22-20-18)16-11-12-16/h2-10,16-17,21H,11-12H2,1H3.
What are the key properties of 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol?
5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol has a molecular weight of 293.37 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-(4-methylphenyl)-4-phenyl-4H-1,2-oxazol-5-ol is sourced from PubChem (CID 59857619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).