methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate

C15H14N2O3S2 — CID 178077292

IUPACmethyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate
SMILESCOC(=O)c1c(C)sc2cnc(OCc3cnc(C)s3)cc12
InChIInChI=1S/C15H14N2O3S2/c1-8-14(15(18)19-3)11-4-13(17-6-12(11)21-8)20-7-10-5-16-9(2)22-10/h4-6H,7H2,1-3H3
InChIKeyBWVQDEJLOYTRRJ-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.74
Rot. Bonds4

About methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate

methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate (PubChem CID 178077292) has the molecular formula C15H14N2O3S2 and a molecular weight of 334.42 g/mol. Its IUPAC name is methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate
PubChem CID178077292
Molecular FormulaC15H14N2O3S2
Molecular Weight334.42 g/mol
Exact Mass334.04
IUPAC Namemethyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate
SMILESCOC(=O)c1c(C)sc2cnc(OCc3cnc(C)s3)cc12
InChIInChI=1S/C15H14N2O3S2/c1-8-14(15(18)19-3)11-4-13(17-6-12(11)21-8)20-7-10-5-16-9(2)22-10/h4-6H,7H2,1-3H3
InChIKeyBWVQDEJLOYTRRJ-UHFFFAOYSA-N
XLogP3.74
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]-2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]furo[2,3-c]pyridine-3-carboxamide
CID 170359186
N-[(2-methyl-1,3-thiazol-5-yl)methoxy]acetamide
CID 130635341
2-[(2-methyl-1,3-thiazol-5-yl)methoxy]acetic acid
CID 53397348
3-methoxy-4-[(2-methyl-1,3-thiazol-5-yl)methoxy]benzoic acid
CID 63019580
methyl 2-methyl-3-[(2-methyl-1,3-thiazol-5-yl)methyl]imidazole-4-carboxylate
CID 65171351
methyl 4-[(2-methyl-1,3-thiazol-5-yl)methylamino]pyridine-2-carboxylate
CID 66285848
3-[(2-methyl-1,3-thiazol-5-yl)methoxy]benzoic acid
CID 63019403
1-[4-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanone
CID 55151683
methyl 2-(methoxymethyl)-5-methyl-1-benzothiophene-3-carboxylate
CID 126592526
3-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenol
CID 63020479
methyl 4-fluoro-2-[(2-methyl-1,3-thiazol-5-yl)methylamino]benzoate
CID 54868582
O-[(2-methyl-1,3-thiazol-5-yl)methyl]hydroxylamine;dihydrochloride
CID 155978412

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate?
The IUPAC name of methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate (CID 178077292) is methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate?
The canonical SMILES for methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate is COC(=O)c1c(C)sc2cnc(OCc3cnc(C)s3)cc12.
What is the InChIKey of methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate?
The InChIKey is BWVQDEJLOYTRRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3S2/c1-8-14(15(18)19-3)11-4-13(17-6-12(11)21-8)20-7-10-5-16-9(2)22-10/h4-6H,7H2,1-3H3.
What are the key properties of methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate?
methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate has a molecular weight of 334.42 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]thieno[2,3-c]pyridine-3-carboxylate is sourced from PubChem (CID 178077292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).