(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol

C17H15FN2O4 — CID 97243398

IUPAC(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
SMILESO[C@@H](COc1ccc(F)cc1)COc1ccc(-c2nnco2)cc1
InChIInChI=1S/C17H15FN2O4/c18-13-3-7-16(8-4-13)23-10-14(21)9-22-15-5-1-12(2-6-15)17-20-19-11-24-17/h1-8,11,14,21H,9-10H2/t14-/m1/s1
InChIKeyGAQFMLGKJXVNTA-CQSZACIVSA-N
MW330.32 g/mol
LogP2.69
Rot. Bonds7

About (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol

(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol (PubChem CID 97243398) has the molecular formula C17H15FN2O4 and a molecular weight of 330.32 g/mol. Its IUPAC name is (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
PubChem CID97243398
Molecular FormulaC17H15FN2O4
Molecular Weight330.32 g/mol
Exact Mass330.10
IUPAC Name(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
SMILESO[C@@H](COc1ccc(F)cc1)COc1ccc(-c2nnco2)cc1
InChIInChI=1S/C17H15FN2O4/c18-13-3-7-16(8-4-13)23-10-14(21)9-22-15-5-1-12(2-6-15)17-20-19-11-24-17/h1-8,11,14,21H,9-10H2/t14-/m1/s1
InChIKeyGAQFMLGKJXVNTA-CQSZACIVSA-N
XLogP2.69
TPSA77.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.32
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol with MolForge

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Related Compounds

(2S)-1-[4-[(2S)-2-hydroxy-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propyl]piperazin-1-yl]-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
CID 34175570
1,3-bis(4-fluorophenoxy)propan-2-ol
CID 109412822
1-[benzyl(methyl)amino]-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
CID 109414479
1-[4-(4-fluorophenyl)piperazin-1-yl]-3-[3-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
CID 5298503
1-(4-fluorophenoxy)-3-methoxypropan-2-ol
CID 86691234
N-(3,5-difluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 42368891
N-methyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 8001302
4-(4-fluorophenoxy)-3-hydroxybutanoic acid
CID 22564574
(2S)-N-[(1S)-1-(4-fluorophenyl)ethyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 8528203
N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 16589195
1-(4-fluorophenoxy)-4-methylpentan-2-ol
CID 117241745
1-[4-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperazin-1-yl]-3-phenoxypropan-2-ol
CID 86895568

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol?
The IUPAC name of (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol (CID 97243398) is (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol.
What is the SMILES notation for (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol?
The canonical SMILES for (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol is O[C@@H](COc1ccc(F)cc1)COc1ccc(-c2nnco2)cc1.
What is the InChIKey of (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol?
The InChIKey is GAQFMLGKJXVNTA-CQSZACIVSA-N. The full InChI is InChI=1S/C17H15FN2O4/c18-13-3-7-16(8-4-13)23-10-14(21)9-22-15-5-1-12(2-6-15)17-20-19-11-24-17/h1-8,11,14,21H,9-10H2/t14-/m1/s1.
What are the key properties of (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol?
(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol has a molecular weight of 330.32 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol is sourced from PubChem (CID 97243398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).