2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol

C10H15NO3 — CID 115021002

IUPAC2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol
SMILESOCCc1nc(C2CCOCC2)co1
InChIInChI=1S/C10H15NO3/c12-4-1-10-11-9(7-14-10)8-2-5-13-6-3-8/h7-8,12H,1-6H2
InChIKeyNOIXNFATPAXPOF-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.10
Rot. Bonds3

About 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol

2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol (PubChem CID 115021002) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol
PubChem CID115021002
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol
SMILESOCCc1nc(C2CCOCC2)co1
InChIInChI=1S/C10H15NO3/c12-4-1-10-11-9(7-14-10)8-2-5-13-6-3-8/h7-8,12H,1-6H2
InChIKeyNOIXNFATPAXPOF-UHFFFAOYSA-N
XLogP1.10
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol?
The IUPAC name of 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol (CID 115021002) is 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol.
What is the SMILES notation for 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol?
The canonical SMILES for 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol is OCCc1nc(C2CCOCC2)co1.
What is the InChIKey of 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol?
The InChIKey is NOIXNFATPAXPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c12-4-1-10-11-9(7-14-10)8-2-5-13-6-3-8/h7-8,12H,1-6H2.
What are the key properties of 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol?
2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol has a molecular weight of 197.23 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(oxan-4-yl)-1,3-oxazol-2-yl]ethanol is sourced from PubChem (CID 115021002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).