methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate

C11H12N2O2S — CID 76850514

IUPACmethyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate
SMILESCCc1nc2c(C(=O)OC)nc(C)cc2s1
InChIInChI=1S/C11H12N2O2S/c1-4-8-13-9-7(16-8)5-6(2)12-10(9)11(14)15-3/h5H,4H2,1-3H3
InChIKeyHKFOZCJFBCTMJJ-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.35
Rot. Bonds2

About methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate

methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate (PubChem CID 76850514) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate
PubChem CID76850514
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Namemethyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate
SMILESCCc1nc2c(C(=O)OC)nc(C)cc2s1
InChIInChI=1S/C11H12N2O2S/c1-4-8-13-9-7(16-8)5-6(2)12-10(9)11(14)15-3/h5H,4H2,1-3H3
InChIKeyHKFOZCJFBCTMJJ-UHFFFAOYSA-N
XLogP2.35
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-ethyl-5-(3-methylphenyl)-1,3-thiazole-4-carboxylate
CID 123763604
methyl 4-chloro-6-methyl-[1,3]thiazolo[4,5-c]pyridine-2-carboxylate
CID 76850497
dimethyl 4-butyl-6-methylpyridine-2,3-dicarboxylate
CID 44521370
methyl 5-ethyl-2-methyl-1,3-thiazole-4-carboxylate
CID 4275287
2-ethyl-4-fluoro-1,3-benzothiazole-6-carboxamide
CID 145100828
methyl 4-bromo-3-hydroxy-6-methylpyridine-2-carboxylate
CID 142367193
methyl 2-(2,6-dimethyl-4-pyridinyl)-5-methyl-1,3-thiazole-4-carboxylate
CID 107502186
methyl 4-(chloromethyl)-3-(difluoromethyl)-6-methylpyridine-2-carboxylate
CID 130090590
methyl 5-methyl-2-propyl-1,3-thiazole-4-carboxylate
CID 115422950
methyl 3-cyano-4,6-dimethylpyridine-2-carboxylate
CID 130298670
methyl 3-chloro-4-methoxy-6-methylpyridine-2-carboxylate
CID 142574242
2,4,5-triethyl-1,3-benzothiazole-6-sulfonic acid
CID 141485017

Frequently Asked Questions

What is the IUPAC name of methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate?
The IUPAC name of methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate (CID 76850514) is methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate.
What is the SMILES notation for methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate?
The canonical SMILES for methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate is CCc1nc2c(C(=O)OC)nc(C)cc2s1.
What is the InChIKey of methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate?
The InChIKey is HKFOZCJFBCTMJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-4-8-13-9-7(16-8)5-6(2)12-10(9)11(14)15-3/h5H,4H2,1-3H3.
What are the key properties of methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate?
methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate has a molecular weight of 236.30 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-ethyl-6-methyl-[1,3]thiazolo[4,5-c]pyridine-4-carboxylate is sourced from PubChem (CID 76850514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).