2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine

C11H18N2O2 — CID 115026943

IUPAC2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCCc1oc(CCN)nc1C1CCCO1
InChIInChI=1S/C11H18N2O2/c1-2-8-11(9-4-3-7-14-9)13-10(15-8)5-6-12/h9H,2-7,12H2,1H3
InChIKeyLLUKUPIRYFGNOY-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.59
Rot. Bonds4

About 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine

2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 115026943) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine
PubChem CID115026943
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCCc1oc(CCN)nc1C1CCCO1
InChIInChI=1S/C11H18N2O2/c1-2-8-11(9-4-3-7-14-9)13-10(15-8)5-6-12/h9H,2-7,12H2,1H3
InChIKeyLLUKUPIRYFGNOY-UHFFFAOYSA-N
XLogP1.59
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine (CID 115026943) is 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine is CCc1oc(CCN)nc1C1CCCO1.
What is the InChIKey of 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is LLUKUPIRYFGNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-8-11(9-4-3-7-14-9)13-10(15-8)5-6-12/h9H,2-7,12H2,1H3.
What are the key properties of 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine?
2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 210.28 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-ethyl-4-(oxolan-2-yl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 115026943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).