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

C15H20N2O4 — CID 63364675

IUPAC(1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
SMILESCCCc1noc(COc2ccc([C@@H](C)O)cc2OC)n1
InChIInChI=1S/C15H20N2O4/c1-4-5-14-16-15(21-17-14)9-20-12-7-6-11(10(2)18)8-13(12)19-3/h6-8,10,18H,4-5,9H2,1-3H3/t10-/m1/s1
InChIKeyQNQYPTNOVRFUGN-SNVBAGLBSA-N
MW292.34 g/mol
LogP2.66
Rot. Bonds7

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

(1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol (PubChem CID 63364675) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
PubChem CID63364675
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name(1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
SMILESCCCc1noc(COc2ccc([C@@H](C)O)cc2OC)n1
InChIInChI=1S/C15H20N2O4/c1-4-5-14-16-15(21-17-14)9-20-12-7-6-11(10(2)18)8-13(12)19-3/h6-8,10,18H,4-5,9H2,1-3H3/t10-/m1/s1
InChIKeyQNQYPTNOVRFUGN-SNVBAGLBSA-N
XLogP2.66
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 ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol (CID 63364675) is (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol is CCCc1noc(COc2ccc([C@@H](C)O)cc2OC)n1.
What is the InChIKey of (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol?
The InChIKey is QNQYPTNOVRFUGN-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-4-5-14-16-15(21-17-14)9-20-12-7-6-11(10(2)18)8-13(12)19-3/h6-8,10,18H,4-5,9H2,1-3H3/t10-/m1/s1.
What are the key properties of (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol?
(1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol has a molecular weight of 292.34 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-methoxy-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 63364675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).