1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol

C13H15NO3 — CID 111448152

IUPAC1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol
SMILESCCC(O)c1ccc(OCc2ccon2)cc1
InChIInChI=1S/C13H15NO3/c1-2-13(15)10-3-5-12(6-4-10)16-9-11-7-8-17-14-11/h3-8,13,15H,2,9H2,1H3
InChIKeyFWPNWZXPMJEUIT-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.70
Rot. Bonds5

About 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol

1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol (PubChem CID 111448152) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol.

Molecular Properties

Compound Name1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol
PubChem CID111448152
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol
SMILESCCC(O)c1ccc(OCc2ccon2)cc1
InChIInChI=1S/C13H15NO3/c1-2-13(15)10-3-5-12(6-4-10)16-9-11-7-8-17-14-11/h3-8,13,15H,2,9H2,1H3
InChIKeyFWPNWZXPMJEUIT-UHFFFAOYSA-N
XLogP2.70
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(1,3-thiazol-4-ylmethoxy)phenyl]propan-1-ol
CID 43504474
(1S)-1-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
CID 55189009
(1R)-1-[4-[(1-propan-2-ylpyrazol-3-yl)methoxy]phenyl]propan-1-ol
CID 64773103
(1R)-1-[4-(pyridin-3-ylmethoxy)phenyl]propan-1-ol
CID 55189539
1-(4-butoxyphenyl)propan-1-ol
CID 19979001
2-[4-(1,2-oxazol-3-ylmethoxy)phenyl]acetic acid
CID 117094930
1-[4-[(4-iodophenyl)methoxy]phenyl]propan-1-ol
CID 65476802
1-[4-(1-hydroxypropyl)phenoxy]butan-2-ol
CID 60887102
(1S)-1-[4-(ethoxymethoxy)phenyl]propan-1-ol
CID 79005366
1-[4-(2-methylsulfanylethoxy)phenyl]propan-1-ol
CID 115900486
1-(4-but-2-ynoxyphenyl)propan-1-ol
CID 62311750
6-[4-[(1R)-1-hydroxypropyl]phenoxy]hexan-1-ol
CID 107704156

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol?
The IUPAC name of 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol (CID 111448152) is 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol.
What is the SMILES notation for 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol?
The canonical SMILES for 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol is CCC(O)c1ccc(OCc2ccon2)cc1.
What is the InChIKey of 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol?
The InChIKey is FWPNWZXPMJEUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3/c1-2-13(15)10-3-5-12(6-4-10)16-9-11-7-8-17-14-11/h3-8,13,15H,2,9H2,1H3.
What are the key properties of 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol?
1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol has a molecular weight of 233.27 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1,2-oxazol-3-ylmethoxy)phenyl]propan-1-ol is sourced from PubChem (CID 111448152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).