3-(1-cyclopropylethyl)-1,2-oxazol-5-amine

C8H12N2O — CID 83155218

IUPAC3-(1-cyclopropylethyl)-1,2-oxazol-5-amine
SMILESCC(c1cc(N)on1)C1CC1
InChIInChI=1S/C8H12N2O/c1-5(6-2-3-6)7-4-8(9)11-10-7/h4-6H,2-3,9H2,1H3
InChIKeyRULFBUJWNSVRSE-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.77
Rot. Bonds2

About 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine

3-(1-cyclopropylethyl)-1,2-oxazol-5-amine (PubChem CID 83155218) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(1-cyclopropylethyl)-1,2-oxazol-5-amine
PubChem CID83155218
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name3-(1-cyclopropylethyl)-1,2-oxazol-5-amine
SMILESCC(c1cc(N)on1)C1CC1
InChIInChI=1S/C8H12N2O/c1-5(6-2-3-6)7-4-8(9)11-10-7/h4-6H,2-3,9H2,1H3
InChIKeyRULFBUJWNSVRSE-UHFFFAOYSA-N
XLogP1.77
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine (CID 83155218) is 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine is CC(c1cc(N)on1)C1CC1.
What is the InChIKey of 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine?
The InChIKey is RULFBUJWNSVRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-5(6-2-3-6)7-4-8(9)11-10-7/h4-6H,2-3,9H2,1H3.
What are the key properties of 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine?
3-(1-cyclopropylethyl)-1,2-oxazol-5-amine has a molecular weight of 152.20 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylethyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 83155218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).