1-(1,2-oxazol-3-yl)ethanol

C5H7NO2 — CID 23164725

IUPAC1-(1,2-oxazol-3-yl)ethanol
SMILESCC(O)c1ccon1
InChIInChI=1S/C5H7NO2/c1-4(7)5-2-3-8-6-5/h2-4,7H,1H3
InChIKeyOJSDNYAMXINJQD-UHFFFAOYSA-N
MW113.12 g/mol
LogP0.73
Rot. Bonds1

About 1-(1,2-oxazol-3-yl)ethanol

1-(1,2-oxazol-3-yl)ethanol (PubChem CID 23164725) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is 1-(1,2-oxazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(1,2-oxazol-3-yl)ethanol
PubChem CID23164725
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name1-(1,2-oxazol-3-yl)ethanol
SMILESCC(O)c1ccon1
InChIInChI=1S/C5H7NO2/c1-4(7)5-2-3-8-6-5/h2-4,7H,1H3
InChIKeyOJSDNYAMXINJQD-UHFFFAOYSA-N
XLogP0.73
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-Methyl-1,2-oxazol-3-yl)methanol
CID 2736567
1,2-Oxazol-3-ylmethanol
CID 12905096
2-(1,2-Oxazol-3-yl)acetic acid
CID 13042083
1-(5-Methyl-1,2-oxazol-3-yl)ethan-1-ol
CID 13321090
3-Ethyl-1,2-oxazole
CID 12529300
(5-Ethyl-1,2-oxazol-3-yl)methanol
CID 12278245
2-Isoxazol-3-ylethanol
CID 17997979
(1S)-1-(5-methyl-1,2-oxazol-3-yl)ethan-1-ol
CID 13321091
(1R)-1-(5-methyl-1,2-oxazol-3-yl)ethan-1-ol
CID 91647658
(R)-1-(Isoxazol-3-yl)ethanol
CID 154730399
(S)-1-(Isoxazol-3-yl)ethan-1-ol
CID 165968589
Dioxymethylfurazan
CID 66718249

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-oxazol-3-yl)ethanol?
The IUPAC name of 1-(1,2-oxazol-3-yl)ethanol (CID 23164725) is 1-(1,2-oxazol-3-yl)ethanol.
What is the SMILES notation for 1-(1,2-oxazol-3-yl)ethanol?
The canonical SMILES for 1-(1,2-oxazol-3-yl)ethanol is CC(O)c1ccon1.
What is the InChIKey of 1-(1,2-oxazol-3-yl)ethanol?
The InChIKey is OJSDNYAMXINJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2/c1-4(7)5-2-3-8-6-5/h2-4,7H,1H3.
What are the key properties of 1-(1,2-oxazol-3-yl)ethanol?
1-(1,2-oxazol-3-yl)ethanol has a molecular weight of 113.12 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-oxazol-3-yl)ethanol is sourced from PubChem (CID 23164725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).