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

C5H8N2O — CID 19896984

IUPAC1-(1,3-oxazol-2-yl)ethanamine
SMILESCC(N)c1ncco1
InChIInChI=1S/C5H8N2O/c1-4(6)5-7-2-3-8-5/h2-4H,6H2,1H3
InChIKeyCWJDVDQXFIORGV-UHFFFAOYSA-N
MW112.13 g/mol
LogP0.69
Rot. Bonds1

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

1-(1,3-oxazol-2-yl)ethanamine (PubChem CID 19896984) has the molecular formula C5H8N2O and a molecular weight of 112.13 g/mol. Its IUPAC name is 1-(1,3-oxazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(1,3-oxazol-2-yl)ethanamine
PubChem CID19896984
Molecular FormulaC5H8N2O
Molecular Weight112.13 g/mol
Exact Mass112.06
IUPAC Name1-(1,3-oxazol-2-yl)ethanamine
SMILESCC(N)c1ncco1
InChIInChI=1S/C5H8N2O/c1-4(6)5-7-2-3-8-5/h2-4H,6H2,1H3
InChIKeyCWJDVDQXFIORGV-UHFFFAOYSA-N
XLogP0.69
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.13
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyl-1,3-oxazole
CID 12547675
2-Ethyl-1,3-oxazole
CID 14947250
(1,3-Oxazol-2-yl)acetonitrile
CID 20562996
2-Tert-butyl-1,3-oxazole
CID 17858253
2-(Propan-2-yl)-1,3-oxazole
CID 21650900
1-(1,3-Oxazol-2-yl)methanamine hydrochloride
CID 46912060
1-(1,3-Oxazol-2-yl)methanamine dihydrochloride
CID 135355718
2-(Azetidin-3-yl)-1,3-oxazole hydrochloride
CID 138040436
2-(Pyrrolidin-2-yl)-1,3-oxazole hydrochloride
CID 146012688
2,2,2-Trifluoro-1-(1,3-oxazol-2-yl)ethan-1-amine hydrochloride
CID 165985158
2,2,2-Trifluoro-1-(oxazol-2-yl)ethan-1-aminium chloride
CID 168474933
t-Butyl [2,2,2-trifluoro-1-(oxazol-2-yl)ethyl]carbamate
CID 168475031

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-oxazol-2-yl)ethanamine?
The IUPAC name of 1-(1,3-oxazol-2-yl)ethanamine (CID 19896984) is 1-(1,3-oxazol-2-yl)ethanamine.
What is the SMILES notation for 1-(1,3-oxazol-2-yl)ethanamine?
The canonical SMILES for 1-(1,3-oxazol-2-yl)ethanamine is CC(N)c1ncco1.
What is the InChIKey of 1-(1,3-oxazol-2-yl)ethanamine?
The InChIKey is CWJDVDQXFIORGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O/c1-4(6)5-7-2-3-8-5/h2-4H,6H2,1H3.
What are the key properties of 1-(1,3-oxazol-2-yl)ethanamine?
1-(1,3-oxazol-2-yl)ethanamine has a molecular weight of 112.13 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-oxazol-2-yl)ethanamine is sourced from PubChem (CID 19896984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).