(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol

C15H20N2O4 — CID 97029342

IUPAC(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol
SMILESCCO[C@@H](C)c1noc(COc2cccc([C@@H](C)O)c2)n1
InChIInChI=1S/C15H20N2O4/c1-4-19-11(3)15-16-14(21-17-15)9-20-13-7-5-6-12(8-13)10(2)18/h5-8,10-11,18H,4,9H2,1-3H3/t10-,11+/m1/s1
InChIKeyVLDIIUKJKHIZTM-MNOVXSKESA-N
MW292.34 g/mol
LogP2.80
Rot. Bonds7

About (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol

(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol (PubChem CID 97029342) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol
PubChem CID97029342
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol
SMILESCCO[C@@H](C)c1noc(COc2cccc([C@@H](C)O)c2)n1
InChIInChI=1S/C15H20N2O4/c1-4-19-11(3)15-16-14(21-17-15)9-20-13-7-5-6-12(8-13)10(2)18/h5-8,10-11,18H,4,9H2,1-3H3/t10-,11+/m1/s1
InChIKeyVLDIIUKJKHIZTM-MNOVXSKESA-N
XLogP2.80
TPSA77.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-[3-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
CID 78934177
(1R)-1-[3-[(3-ethyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
CID 55189536
3-[(1R)-1-ethoxyethyl]-5-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazole
CID 95770468
3-[[3-(1-ethoxy-2-methylpropyl)-1,2,4-oxadiazol-5-yl]methoxy]aniline
CID 116703092
(1R)-1-[3-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]ethanol
CID 63365604
4-[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]butan-2-ol
CID 64534643
1-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
CID 43503686
1-[3-[(4-iodophenyl)methoxy]phenyl]ethanol
CID 65476801
1-[3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanamine
CID 54961430
(1S)-1-[3-[(2-propyl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 78933888
(1S)-1-[3-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 78933301
(1R)-1-[3-[(3,4-dimethylphenyl)methoxy]phenyl]ethanol
CID 55190777

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol (CID 97029342) is (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol is CCO[C@@H](C)c1noc(COc2cccc([C@@H](C)O)c2)n1.
What is the InChIKey of (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol?
The InChIKey is VLDIIUKJKHIZTM-MNOVXSKESA-N. The full InChI is InChI=1S/C15H20N2O4/c1-4-19-11(3)15-16-14(21-17-15)9-20-13-7-5-6-12(8-13)10(2)18/h5-8,10-11,18H,4,9H2,1-3H3/t10-,11+/m1/s1.
What are the key properties of (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol?
(1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol has a molecular weight of 292.34 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-[[3-[(1S)-1-ethoxyethyl]-1,2,4-oxadiazol-5-yl]methoxy]phenyl]ethanol is sourced from PubChem (CID 97029342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).