5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole

C12H19NO2 — CID 134432288

IUPAC5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole
SMILESCCC1CCC(c2cc(OC)no2)CC1
InChIInChI=1S/C12H19NO2/c1-3-9-4-6-10(7-5-9)11-8-12(14-2)13-15-11/h8-10H,3-7H2,1-2H3
InChIKeyONRONPNLHGEZCM-UHFFFAOYSA-N
MW209.29 g/mol
LogP3.37
Rot. Bonds3

About 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole

5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole (PubChem CID 134432288) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole.

Molecular Properties

Compound Name5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole
PubChem CID134432288
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole
SMILESCCC1CCC(c2cc(OC)no2)CC1
InChIInChI=1S/C12H19NO2/c1-3-9-4-6-10(7-5-9)11-8-12(14-2)13-15-11/h8-10H,3-7H2,1-2H3
InChIKeyONRONPNLHGEZCM-UHFFFAOYSA-N
XLogP3.37
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole?
The IUPAC name of 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole (CID 134432288) is 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole.
What is the SMILES notation for 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole?
The canonical SMILES for 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole is CCC1CCC(c2cc(OC)no2)CC1.
What is the InChIKey of 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole?
The InChIKey is ONRONPNLHGEZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-3-9-4-6-10(7-5-9)11-8-12(14-2)13-15-11/h8-10H,3-7H2,1-2H3.
What are the key properties of 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole?
5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole has a molecular weight of 209.29 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylcyclohexyl)-3-methoxy-1,2-oxazole is sourced from PubChem (CID 134432288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).