4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol

C15H13NO2 — CID 136740069

IUPAC4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol
SMILESOc1ccc(-c2ccc(C3=NCCO3)cc2)cc1
InChIInChI=1S/C15H13NO2/c17-14-7-5-12(6-8-14)11-1-3-13(4-2-11)15-16-9-10-18-15/h1-8,17H,9-10H2
InChIKeyUSGDHZMFTDLWBU-UHFFFAOYSA-N
MW239.27 g/mol
LogP2.84
Rot. Bonds2

About 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol

4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol (PubChem CID 136740069) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol.

Molecular Properties

Compound Name4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol
PubChem CID136740069
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol
SMILESOc1ccc(-c2ccc(C3=NCCO3)cc2)cc1
InChIInChI=1S/C15H13NO2/c17-14-7-5-12(6-8-14)11-1-3-13(4-2-11)15-16-9-10-18-15/h1-8,17H,9-10H2
InChIKeyUSGDHZMFTDLWBU-UHFFFAOYSA-N
XLogP2.84
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol?
The IUPAC name of 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol (CID 136740069) is 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol.
What is the SMILES notation for 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol?
The canonical SMILES for 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol is Oc1ccc(-c2ccc(C3=NCCO3)cc2)cc1.
What is the InChIKey of 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol?
The InChIKey is USGDHZMFTDLWBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c17-14-7-5-12(6-8-14)11-1-3-13(4-2-11)15-16-9-10-18-15/h1-8,17H,9-10H2.
What are the key properties of 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol?
4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol has a molecular weight of 239.27 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]phenol is sourced from PubChem (CID 136740069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).