5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine

C10H9N3O2S — CID 82389467

IUPAC5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine
SMILESCCc1sc2c(-c3ccon3)noc2c1N
InChIInChI=1S/C10H9N3O2S/c1-2-6-7(11)9-10(16-6)8(13-15-9)5-3-4-14-12-5/h3-4H,2,11H2,1H3
InChIKeyJGSAHZTVHOBZPF-UHFFFAOYSA-N
MW235.27 g/mol
LogP2.69
Rot. Bonds2

About 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine

5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine (PubChem CID 82389467) has the molecular formula C10H9N3O2S and a molecular weight of 235.27 g/mol. Its IUPAC name is 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine.

Molecular Properties

Compound Name5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine
PubChem CID82389467
Molecular FormulaC10H9N3O2S
Molecular Weight235.27 g/mol
Exact Mass235.04
IUPAC Name5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine
SMILESCCc1sc2c(-c3ccon3)noc2c1N
InChIInChI=1S/C10H9N3O2S/c1-2-6-7(11)9-10(16-6)8(13-15-9)5-3-4-14-12-5/h3-4H,2,11H2,1H3
InChIKeyJGSAHZTVHOBZPF-UHFFFAOYSA-N
XLogP2.69
TPSA78.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The IUPAC name of 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine (CID 82389467) is 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine.
What is the SMILES notation for 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The canonical SMILES for 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine is CCc1sc2c(-c3ccon3)noc2c1N.
What is the InChIKey of 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The InChIKey is JGSAHZTVHOBZPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2S/c1-2-6-7(11)9-10(16-6)8(13-15-9)5-3-4-14-12-5/h3-4H,2,11H2,1H3.
What are the key properties of 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine?
5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine has a molecular weight of 235.27 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(1,2-oxazol-3-yl)thieno[2,3-d][1,2]oxazol-6-amine is sourced from PubChem (CID 82389467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).