2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol

C20H16N2O2 — CID 137086219

IUPAC2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol
SMILESOc1ccccc1-c1cccc(C2=N[C@H](c3ccccc3)CO2)n1
InChIInChI=1S/C20H16N2O2/c23-19-12-5-4-9-15(19)16-10-6-11-17(21-16)20-22-18(13-24-20)14-7-2-1-3-8-14/h1-12,18,23H,13H2/t18-/m0/s1
InChIKeyCWDFFYBSWBUGIW-SFHVURJKSA-N
MW316.36 g/mol
LogP3.97
Rot. Bonds3

About 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol

2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol (PubChem CID 137086219) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol
PubChem CID137086219
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol
SMILESOc1ccccc1-c1cccc(C2=N[C@H](c3ccccc3)CO2)n1
InChIInChI=1S/C20H16N2O2/c23-19-12-5-4-9-15(19)16-10-6-11-17(21-16)20-22-18(13-24-20)14-7-2-1-3-8-14/h1-12,18,23H,13H2/t18-/m0/s1
InChIKeyCWDFFYBSWBUGIW-SFHVURJKSA-N
XLogP3.97
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol?
The IUPAC name of 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol (CID 137086219) is 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol.
What is the SMILES notation for 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol?
The canonical SMILES for 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol is Oc1ccccc1-c1cccc(C2=N[C@H](c3ccccc3)CO2)n1.
What is the InChIKey of 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol?
The InChIKey is CWDFFYBSWBUGIW-SFHVURJKSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-19-12-5-4-9-15(19)16-10-6-11-17(21-16)20-22-18(13-24-20)14-7-2-1-3-8-14/h1-12,18,23H,13H2/t18-/m0/s1.
What are the key properties of 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol?
2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol has a molecular weight of 316.36 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]phenol is sourced from PubChem (CID 137086219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).