1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone

C10H10N2OS — CID 82395893

IUPAC1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone
SMILESCC(=O)c1sc2nccc(C)c2c1N
InChIInChI=1S/C10H10N2OS/c1-5-3-4-12-10-7(5)8(11)9(14-10)6(2)13/h3-4H,11H2,1-2H3
InChIKeyBFMMSPGDQWXCHL-UHFFFAOYSA-N
MW206.27 g/mol
LogP2.39
Rot. Bonds1

About 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone

1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone (PubChem CID 82395893) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone.

Molecular Properties

Compound Name1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone
PubChem CID82395893
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone
SMILESCC(=O)c1sc2nccc(C)c2c1N
InChIInChI=1S/C10H10N2OS/c1-5-3-4-12-10-7(5)8(11)9(14-10)6(2)13/h3-4H,11H2,1-2H3
InChIKeyBFMMSPGDQWXCHL-UHFFFAOYSA-N
XLogP2.39
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(3-hydroxy-2,2-dimethylpropyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
CID 115366285
3-amino-N-(3,4-dimethylphenyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
CID 171133101
3-amino-4-methyl-N-(5-methylhexyl)thieno[2,3-b]pyridine-2-carboxamide
CID 115327426
3-amino-4-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 106433622
3-amino-N-(4-amino-2-methyl-4-oxobutan-2-yl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
CID 106098617
(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(4-hydroxy-3-methylpiperidin-1-yl)methanone
CID 114683837
4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide
CID 90436738
(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 171133137
(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)-(3-methoxypiperidin-1-yl)methanone
CID 102970996
3-amino-4-methoxy-N,N-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 90436560
3-amino-4-(2-chloro-4,5-dimethylphenoxy)thieno[2,3-b]pyridine-2-carboxamide
CID 25004564
2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane
CID 169181365

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone?
The IUPAC name of 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone (CID 82395893) is 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone.
What is the SMILES notation for 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone?
The canonical SMILES for 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone is CC(=O)c1sc2nccc(C)c2c1N.
What is the InChIKey of 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone?
The InChIKey is BFMMSPGDQWXCHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-5-3-4-12-10-7(5)8(11)9(14-10)6(2)13/h3-4H,11H2,1-2H3.
What are the key properties of 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone?
1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone has a molecular weight of 206.27 g/mol, XLogP of 2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone is sourced from PubChem (CID 82395893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).