(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol

C13H16N2O3 — CID 63365311

IUPAC(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccccc1OCc1noc(C)n1
InChIInChI=1S/C13H16N2O3/c1-3-11(16)10-6-4-5-7-12(10)17-8-13-14-9(2)18-15-13/h4-7,11,16H,3,8H2,1-2H3/t11-/m1/s1
InChIKeyTZRMUZPODIYFRD-LLVKDONJSA-N
MW248.28 g/mol
LogP2.40
Rot. Bonds5

About (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol

(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol (PubChem CID 63365311) has the molecular formula C13H16N2O3 and a molecular weight of 248.28 g/mol. Its IUPAC name is (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol
PubChem CID63365311
Molecular FormulaC13H16N2O3
Molecular Weight248.28 g/mol
Exact Mass248.12
IUPAC Name(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccccc1OCc1noc(C)n1
InChIInChI=1S/C13H16N2O3/c1-3-11(16)10-6-4-5-7-12(10)17-8-13-14-9(2)18-15-13/h4-7,11,16H,3,8H2,1-2H3/t11-/m1/s1
InChIKeyTZRMUZPODIYFRD-LLVKDONJSA-N
XLogP2.40
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanol
CID 43503950
(1R)-1-[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]propan-1-ol
CID 55189160
(1S)-1-(2-phenylmethoxyphenyl)propan-1-ol
CID 63365062
2-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]butanoic acid
CID 119224012
(1R)-1-[2-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-1-ol
CID 103954577
1-[2-[(5-ethyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-amine
CID 61494511
1-(2-ethoxyphenyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]ethanamine
CID 103913111
N-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methyl]propan-2-amine
CID 60881788
N-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methyl]propan-1-amine
CID 60881221
(1R)-1-[3-methoxy-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]ethanol
CID 78931097
(1S)-1-[2-[(3,4-dimethylphenyl)methoxy]phenyl]propan-1-ol
CID 63364047
(1S)-1-[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)methoxy]phenyl]propan-1-ol
CID 78930150

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol?
The IUPAC name of (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol (CID 63365311) is (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol?
The canonical SMILES for (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol is CC[C@@H](O)c1ccccc1OCc1noc(C)n1.
What is the InChIKey of (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol?
The InChIKey is TZRMUZPODIYFRD-LLVKDONJSA-N. The full InChI is InChI=1S/C13H16N2O3/c1-3-11(16)10-6-4-5-7-12(10)17-8-13-14-9(2)18-15-13/h4-7,11,16H,3,8H2,1-2H3/t11-/m1/s1.
What are the key properties of (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol?
(1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol has a molecular weight of 248.28 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-1-ol is sourced from PubChem (CID 63365311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).