2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol

C10H17NO3 — CID 106676468

IUPAC2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol
SMILESCOC(C)(C)Cc1cc(CCO)on1
InChIInChI=1S/C10H17NO3/c1-10(2,13-3)7-8-6-9(4-5-12)14-11-8/h6,12H,4-5,7H2,1-3H3
InChIKeyNZSJDGUZQOPVAJ-UHFFFAOYSA-N
MW199.25 g/mol
LogP1.18
Rot. Bonds5

About 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol

2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol (PubChem CID 106676468) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol.

Molecular Properties

Compound Name2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol
PubChem CID106676468
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol
SMILESCOC(C)(C)Cc1cc(CCO)on1
InChIInChI=1S/C10H17NO3/c1-10(2,13-3)7-8-6-9(4-5-12)14-11-8/h6,12H,4-5,7H2,1-3H3
InChIKeyNZSJDGUZQOPVAJ-UHFFFAOYSA-N
XLogP1.18
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol?
The IUPAC name of 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol (CID 106676468) is 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol.
What is the SMILES notation for 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol?
The canonical SMILES for 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol is COC(C)(C)Cc1cc(CCO)on1.
What is the InChIKey of 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol?
The InChIKey is NZSJDGUZQOPVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3/c1-10(2,13-3)7-8-6-9(4-5-12)14-11-8/h6,12H,4-5,7H2,1-3H3.
What are the key properties of 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol?
2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol has a molecular weight of 199.25 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxy-2-methylpropyl)-1,2-oxazol-5-yl]ethanol is sourced from PubChem (CID 106676468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).