3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide

C15H15N3OS2 — CID 79489443

IUPAC3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(CCc1cccs1)C(=O)c1sc2ncccc2c1N
InChIInChI=1S/C15H15N3OS2/c1-18(8-6-10-4-3-9-20-10)15(19)13-12(16)11-5-2-7-17-14(11)21-13/h2-5,7,9H,6,8,16H2,1H3
InChIKeyXGGMQXYYONRYDC-UHFFFAOYSA-N
MW317.44 g/mol
LogP3.25
Rot. Bonds4

About 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 79489443) has the molecular formula C15H15N3OS2 and a molecular weight of 317.44 g/mol. Its IUPAC name is 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID79489443
Molecular FormulaC15H15N3OS2
Molecular Weight317.44 g/mol
Exact Mass317.07
IUPAC Name3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESCN(CCc1cccs1)C(=O)c1sc2ncccc2c1N
InChIInChI=1S/C15H15N3OS2/c1-18(8-6-10-4-3-9-20-10)15(19)13-12(16)11-5-2-7-17-14(11)21-13/h2-5,7,9H,6,8,16H2,1H3
InChIKeyXGGMQXYYONRYDC-UHFFFAOYSA-N
XLogP3.25
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.44
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-methyl-N-(1-methylsulfanylpropan-2-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 112666890
3-bromo-N-methyl-N-(2-thiophen-2-ylethyl)thiophene-2-carboxamide
CID 79036876
5-amino-N-methyl-N-(2-thiophen-2-ylethyl)-1H-pyrazole-4-carboxamide
CID 79487631
2-amino-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 79019362
4-amino-3,5-dichloro-N-methyl-N-(2-thiophen-2-ylethyl)benzamide
CID 82833096
3-amino-N-methyl-N-(2-thiophen-2-ylethyl)-1H-1,2,4-triazole-5-carboxamide
CID 79494822
4-amino-N-methyl-2-(propylamino)-N-(2-thiophen-2-ylethyl)-1,3-thiazole-5-carboxamide
CID 116671308
N-methyl-N-(2-thiophen-2-ylethyl)-2H-triazole-4-carboxamide
CID 79036798
3-amino-N-methyl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 104741052
4-amino-1-ethyl-N-methyl-N-(2-thiophen-2-ylethyl)pyrazole-3-carboxamide
CID 79476461
2-[[methyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-3-amine
CID 113447468
N-methyl-5-(methylamino)-N-(2-thiophen-2-ylethyl)pyrazine-2-carboxamide
CID 107376172

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide (CID 79489443) is 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide is CN(CCc1cccs1)C(=O)c1sc2ncccc2c1N.
What is the InChIKey of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is XGGMQXYYONRYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS2/c1-18(8-6-10-4-3-9-20-10)15(19)13-12(16)11-5-2-7-17-14(11)21-13/h2-5,7,9H,6,8,16H2,1H3.
What are the key properties of 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 317.44 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-(2-thiophen-2-ylethyl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 79489443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).