2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol

C11H15N3O2 — CID 66130585

IUPAC2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol
SMILESCCCn1cncc1-c1cc(CCO)on1
InChIInChI=1S/C11H15N3O2/c1-2-4-14-8-12-7-11(14)10-6-9(3-5-15)16-13-10/h6-8,15H,2-5H2,1H3
InChIKeyAKAYEACAPPDZHK-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.48
Rot. Bonds5

About 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol

2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol (PubChem CID 66130585) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol.

Molecular Properties

Compound Name2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol
PubChem CID66130585
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol
SMILESCCCn1cncc1-c1cc(CCO)on1
InChIInChI=1S/C11H15N3O2/c1-2-4-14-8-12-7-11(14)10-6-9(3-5-15)16-13-10/h6-8,15H,2-5H2,1H3
InChIKeyAKAYEACAPPDZHK-UHFFFAOYSA-N
XLogP1.48
TPSA64.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol?
The IUPAC name of 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol (CID 66130585) is 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol.
What is the SMILES notation for 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol?
The canonical SMILES for 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol is CCCn1cncc1-c1cc(CCO)on1.
What is the InChIKey of 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol?
The InChIKey is AKAYEACAPPDZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-2-4-14-8-12-7-11(14)10-6-9(3-5-15)16-13-10/h6-8,15H,2-5H2,1H3.
What are the key properties of 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol?
2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol has a molecular weight of 221.26 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-propylimidazol-4-yl)-1,2-oxazol-5-yl]ethanol is sourced from PubChem (CID 66130585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).