1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine

C11H18N2O — CID 83907733

IUPAC1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCC(C)c1cc(C(C)C2(N)CC2)no1
InChIInChI=1S/C11H18N2O/c1-7(2)10-6-9(13-14-10)8(3)11(12)4-5-11/h6-8H,4-5,12H2,1-3H3
InChIKeyAUEVSBBAOFBZKK-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.39
Rot. Bonds3

About 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine

1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine (PubChem CID 83907733) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine
PubChem CID83907733
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine
SMILESCC(C)c1cc(C(C)C2(N)CC2)no1
InChIInChI=1S/C11H18N2O/c1-7(2)10-6-9(13-14-10)8(3)11(12)4-5-11/h6-8H,4-5,12H2,1-3H3
InChIKeyAUEVSBBAOFBZKK-UHFFFAOYSA-N
XLogP2.39
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine (CID 83907733) is 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine is CC(C)c1cc(C(C)C2(N)CC2)no1.
What is the InChIKey of 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine?
The InChIKey is AUEVSBBAOFBZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-7(2)10-6-9(13-14-10)8(3)11(12)4-5-11/h6-8H,4-5,12H2,1-3H3.
What are the key properties of 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine?
1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine has a molecular weight of 194.28 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(5-propan-2-yl-1,2-oxazol-3-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 83907733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).