ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate

C9H10N2O2S2 — CID 2763729

IUPACethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
SMILESCCOC(=O)c1sc2nsc(C)c2c1N
InChIInChI=1S/C9H10N2O2S2/c1-3-13-9(12)7-6(10)5-4(2)15-11-8(5)14-7/h3,10H2,1-2H3
InChIKeyWRIWXKCVJAGUIR-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.43
Rot. Bonds2

About ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate

ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate (PubChem CID 2763729) has the molecular formula C9H10N2O2S2 and a molecular weight of 242.32 g/mol. Its IUPAC name is ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate.

Molecular Properties

Compound Nameethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
PubChem CID2763729
Molecular FormulaC9H10N2O2S2
Molecular Weight242.32 g/mol
Exact Mass242.02
IUPAC Nameethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
SMILESCCOC(=O)c1sc2nsc(C)c2c1N
InChIInChI=1S/C9H10N2O2S2/c1-3-13-9(12)7-6(10)5-4(2)15-11-8(5)14-7/h3,10H2,1-2H3
InChIKeyWRIWXKCVJAGUIR-UHFFFAOYSA-N
XLogP2.43
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate?
The IUPAC name of ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate (CID 2763729) is ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate.
What is the SMILES notation for ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate?
The canonical SMILES for ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate is CCOC(=O)c1sc2nsc(C)c2c1N.
What is the InChIKey of ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate?
The InChIKey is WRIWXKCVJAGUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2S2/c1-3-13-9(12)7-6(10)5-4(2)15-11-8(5)14-7/h3,10H2,1-2H3.
What are the key properties of ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate?
ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate has a molecular weight of 242.32 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate is sourced from PubChem (CID 2763729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).