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

C10H9N3O2S — CID 82389470

IUPAC5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine
SMILESCc1ncc(-c2noc3c(N)c(C)sc23)o1
InChIInChI=1S/C10H9N3O2S/c1-4-7(11)9-10(16-4)8(13-15-9)6-3-12-5(2)14-6/h3H,11H2,1-2H3
InChIKeyVOVLEAHAGVCFRV-UHFFFAOYSA-N
MW235.27 g/mol
LogP2.74
Rot. Bonds1

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

5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine (PubChem CID 82389470) has the molecular formula C10H9N3O2S and a molecular weight of 235.27 g/mol. Its IUPAC name is 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine.

Molecular Properties

Compound Name5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine
PubChem CID82389470
Molecular FormulaC10H9N3O2S
Molecular Weight235.27 g/mol
Exact Mass235.04
IUPAC Name5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine
SMILESCc1ncc(-c2noc3c(N)c(C)sc23)o1
InChIInChI=1S/C10H9N3O2S/c1-4-7(11)9-10(16-4)8(13-15-9)6-3-12-5(2)14-6/h3H,11H2,1-2H3
InChIKeyVOVLEAHAGVCFRV-UHFFFAOYSA-N
XLogP2.74
TPSA78.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.27
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The IUPAC name of 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine (CID 82389470) is 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine.
What is the SMILES notation for 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The canonical SMILES for 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine is Cc1ncc(-c2noc3c(N)c(C)sc23)o1.
What is the InChIKey of 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine?
The InChIKey is VOVLEAHAGVCFRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2S/c1-4-7(11)9-10(16-4)8(13-15-9)6-3-12-5(2)14-6/h3H,11H2,1-2H3.
What are the key properties of 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine?
5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine has a molecular weight of 235.27 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(2-methyl-1,3-oxazol-5-yl)thieno[2,3-d][1,2]oxazol-6-amine is sourced from PubChem (CID 82389470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).