5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one

C15H16N2OS2 — CID 115912125

IUPAC5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one
SMILESCC(NCCn1ccc2sccc2c1=O)c1cccs1
InChIInChI=1S/C15H16N2OS2/c1-11(13-3-2-9-19-13)16-6-8-17-7-4-14-12(15(17)18)5-10-20-14/h2-5,7,9-11,16H,6,8H2,1H3
InChIKeyCEJMSEXGAWHRKF-UHFFFAOYSA-N
MW304.44 g/mol
LogP3.48
Rot. Bonds5

About 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one

5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one (PubChem CID 115912125) has the molecular formula C15H16N2OS2 and a molecular weight of 304.44 g/mol. Its IUPAC name is 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one
PubChem CID115912125
Molecular FormulaC15H16N2OS2
Molecular Weight304.44 g/mol
Exact Mass304.07
IUPAC Name5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one
SMILESCC(NCCn1ccc2sccc2c1=O)c1cccs1
InChIInChI=1S/C15H16N2OS2/c1-11(13-3-2-9-19-13)16-6-8-17-7-4-14-12(15(17)18)5-10-20-14/h2-5,7,9-11,16H,6,8H2,1H3
InChIKeyCEJMSEXGAWHRKF-UHFFFAOYSA-N
XLogP3.48
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one 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

5-[2-(2-methoxyethylamino)ethyl]thieno[3,2-c]pyridin-4-one
CID 112557132
N-[2-(7-ethylindol-1-yl)ethyl]-1-thiophen-2-ylethanamine
CID 63504332
5-[2-(prop-2-enylamino)ethyl]thieno[3,2-c]pyridin-4-one
CID 112557143
5-ethylthieno[3,2-c]pyridin-4-one
CID 115886528
N-[2-(3-chloroindol-1-yl)ethyl]-1-thiophen-2-ylethanamine
CID 62804293
N-[2-(4-methoxyindol-1-yl)ethyl]-1-thiophen-2-ylethanamine
CID 83164912
2-(1-thiophen-2-ylethylamino)ethanol
CID 43151185
1-[2-(1-thiophen-2-ylethylamino)ethyl]-5-(trifluoromethyl)pyridin-2-one
CID 63279959
5-[2-(2-butoxyethylamino)ethyl]thieno[3,2-c]pyridin-4-one
CID 115912105
5-but-2-ynylthieno[3,2-c]pyridin-4-one
CID 115886548
3-(4-oxothieno[3,2-c]pyridin-5-yl)propanoic acid
CID 112556961
5-[2-(cyclohexylmethylamino)ethyl]thieno[3,2-c]pyridin-4-one
CID 115912100

Frequently Asked Questions

What is the IUPAC name of 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one?
The IUPAC name of 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one (CID 115912125) is 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one.
What is the SMILES notation for 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one?
The canonical SMILES for 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one is CC(NCCn1ccc2sccc2c1=O)c1cccs1.
What is the InChIKey of 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one?
The InChIKey is CEJMSEXGAWHRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS2/c1-11(13-3-2-9-19-13)16-6-8-17-7-4-14-12(15(17)18)5-10-20-14/h2-5,7,9-11,16H,6,8H2,1H3.
What are the key properties of 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one?
5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one has a molecular weight of 304.44 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1-thiophen-2-ylethylamino)ethyl]thieno[3,2-c]pyridin-4-one is sourced from PubChem (CID 115912125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).