3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide

C16H15N3O2S — CID 155201860

IUPAC3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2sc3ncc(C)cc3c2N)cc1
InChIInChI=1S/C16H15N3O2S/c1-9-7-12-13(17)14(22-16(12)18-8-9)15(20)19-10-3-5-11(21-2)6-4-10/h3-8H,17H2,1-2H3,(H,19,20)
InChIKeyCUPOPGXVYLJMJB-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.45
Rot. Bonds3

About 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide

3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 155201860) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID155201860
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC Name3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2sc3ncc(C)cc3c2N)cc1
InChIInChI=1S/C16H15N3O2S/c1-9-7-12-13(17)14(22-16(12)18-8-9)15(20)19-10-3-5-11(21-2)6-4-10/h3-8H,17H2,1-2H3,(H,19,20)
InChIKeyCUPOPGXVYLJMJB-UHFFFAOYSA-N
XLogP3.45
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-7-methoxy-N-(4-methoxyphenyl)thieno[2,3-b]quinoline-2-carboxamide
CID 1132039
3-amino-5-benzoyl-N-(4-methoxyphenyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 155812590
3-amino-5-[hydroxy-(4-methoxyphenyl)methyl]-N-(4-methoxyphenyl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 162421447
3-amino-5-hydroxy-N-(4-methoxyphenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
CID 155805195
3-amino-N-(4-bromophenyl)-5-[hydroxy-(4-methoxyphenyl)methyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 162421469
3-amino-N-(4-methoxyphenyl)-6-methyl-5-[(E)-3-phenylprop-2-enoyl]thieno[2,3-b]pyridine-2-carboxamide
CID 155927135
3-amino-5-methyl-6-(4-methylphenyl)-N-[4-(trifluoromethoxy)phenyl]thieno[2,3-b]pyridine-2-carboxamide
CID 87048225
3-amino-N-(4-ethoxyphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 734377
6-amino-N-(4-methylphenyl)-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),5,8-tetraene-5-carboxamide
CID 839017
N-(4-acetamidophenyl)-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 23944865
3-amino-6-ethoxy-N-phenylthieno[2,3-b]quinoline-2-carboxamide
CID 1156787
6-amino-N-(4-methylphenyl)-4-thia-2-azatricyclo[7.5.0.03,7]tetradeca-1,3(7),5,8-tetraene-5-carboxamide
CID 1023419

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide (CID 155201860) is 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide is COc1ccc(NC(=O)c2sc3ncc(C)cc3c2N)cc1.
What is the InChIKey of 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is CUPOPGXVYLJMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c1-9-7-12-13(17)14(22-16(12)18-8-9)15(20)19-10-3-5-11(21-2)6-4-10/h3-8H,17H2,1-2H3,(H,19,20).
What are the key properties of 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 313.38 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-methoxyphenyl)-5-methylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 155201860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).