6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine

C22H16N2O4 — CID 123239986

IUPAC6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine
SMILESC1=C(Oc2cnc3ccoc3c2)NO[C@H]1c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H16N2O4/c1-2-4-16(5-3-1)26-17-8-6-15(7-9-17)20-13-22(24-28-20)27-18-12-21-19(23-14-18)10-11-25-21/h1-14,20,24H/t20-/m1/s1
InChIKeySZQVIJZWBMYCHI-HXUWFJFHSA-N
MW372.38 g/mol
LogP5.12
Rot. Bonds5

About 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine

6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine (PubChem CID 123239986) has the molecular formula C22H16N2O4 and a molecular weight of 372.38 g/mol. Its IUPAC name is 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine.

Molecular Properties

Compound Name6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine
PubChem CID123239986
Molecular FormulaC22H16N2O4
Molecular Weight372.38 g/mol
Exact Mass372.11
IUPAC Name6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine
SMILESC1=C(Oc2cnc3ccoc3c2)NO[C@H]1c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H16N2O4/c1-2-4-16(5-3-1)26-17-8-6-15(7-9-17)20-13-22(24-28-20)27-18-12-21-19(23-14-18)10-11-25-21/h1-14,20,24H/t20-/m1/s1
InChIKeySZQVIJZWBMYCHI-HXUWFJFHSA-N
XLogP5.12
TPSA65.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.38
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine with MolForge

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Related Compounds

(5S)-5-(4-phenoxyphenyl)-3-pyrimidin-5-yloxy-2,5-dihydro-1,2-oxazole
CID 123218116
5-[[(5S)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]pyridine-3-carboxamide
CID 123773067
3-(2-fluorophenoxy)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazole
CID 91516612
methyl 3-[[(5S)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]benzoate
CID 123865223
(5S)-3-bromo-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazole
CID 123530884
(5S)-5-(4-phenoxyphenyl)-3-(1,2,4-triazol-1-yl)-2,5-dihydro-1,2-oxazole
CID 123743793
3-[(5-bromo-3-pyridinyl)oxy]-5-[4-(trifluoromethoxy)phenyl]-2,5-dihydro-1,2-oxazole
CID 90810542
6-[(2-methylpropan-2-yl)oxy]furo[3,2-b]pyridine
CID 89460285
6-([1,3]thiazolo[4,5-b]pyridin-2-yloxy)furo[3,2-b]pyridine
CID 141284113
(5S)-3-[3-(2H-tetrazol-5-yl)phenoxy]-5-[4-(trifluoromethoxy)phenyl]-2,5-dihydro-1,2-oxazole
CID 123179776
6-iodofuro[3,2-b]pyridine
CID 46736890
2-[3-fluoro-5-[[5-[4-(trifluoromethoxy)phenyl]-2,5-dihydro-1,2-oxazol-3-yl]oxy]phenyl]-5-methyl-1,3,4-oxadiazole
CID 91100556

Frequently Asked Questions

What is the IUPAC name of 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine?
The IUPAC name of 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine (CID 123239986) is 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine.
What is the SMILES notation for 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine?
The canonical SMILES for 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine is C1=C(Oc2cnc3ccoc3c2)NO[C@H]1c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine?
The InChIKey is SZQVIJZWBMYCHI-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H16N2O4/c1-2-4-16(5-3-1)26-17-8-6-15(7-9-17)20-13-22(24-28-20)27-18-12-21-19(23-14-18)10-11-25-21/h1-14,20,24H/t20-/m1/s1.
What are the key properties of 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine?
6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine has a molecular weight of 372.38 g/mol, XLogP of 5.12, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(5R)-5-(4-phenoxyphenyl)-2,5-dihydro-1,2-oxazol-3-yl]oxy]furo[3,2-b]pyridine is sourced from PubChem (CID 123239986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).