2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine

C8H12N2O — CID 82074673

IUPAC2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine
SMILESNCCc1cc(C2CC2)on1
InChIInChI=1S/C8H12N2O/c9-4-3-7-5-8(11-10-7)6-1-2-6/h5-6H,1-4,9H2
InChIKeySEMXFXJICAHPHX-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.05
Rot. Bonds3

About 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine

2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine (PubChem CID 82074673) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine
PubChem CID82074673
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine
SMILESNCCc1cc(C2CC2)on1
InChIInChI=1S/C8H12N2O/c9-4-3-7-5-8(11-10-7)6-1-2-6/h5-6H,1-4,9H2
InChIKeySEMXFXJICAHPHX-UHFFFAOYSA-N
XLogP1.05
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine?
The IUPAC name of 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine (CID 82074673) is 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine.
What is the SMILES notation for 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine?
The canonical SMILES for 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine is NCCc1cc(C2CC2)on1.
What is the InChIKey of 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine?
The InChIKey is SEMXFXJICAHPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c9-4-3-7-5-8(11-10-7)6-1-2-6/h5-6H,1-4,9H2.
What are the key properties of 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine?
2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine has a molecular weight of 152.20 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyclopropyl-1,2-oxazol-3-yl)ethanamine is sourced from PubChem (CID 82074673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).