3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine

C9H11N5S — CID 66276232

IUPAC3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine
SMILESNc1nc(N2CCc3sccc3C2)n[nH]1
InChIInChI=1S/C9H11N5S/c10-8-11-9(13-12-8)14-3-1-7-6(5-14)2-4-15-7/h2,4H,1,3,5H2,(H3,10,11,12,13)
InChIKeyINNXVIFTDRBJGB-UHFFFAOYSA-N
MW221.29 g/mol
LogP1.01
Rot. Bonds1

About 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine

3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine (PubChem CID 66276232) has the molecular formula C9H11N5S and a molecular weight of 221.29 g/mol. Its IUPAC name is 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine.

Molecular Properties

Compound Name3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine
PubChem CID66276232
Molecular FormulaC9H11N5S
Molecular Weight221.29 g/mol
Exact Mass221.07
IUPAC Name3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine
SMILESNc1nc(N2CCc3sccc3C2)n[nH]1
InChIInChI=1S/C9H11N5S/c10-8-11-9(13-12-8)14-3-1-7-6(5-14)2-4-15-7/h2,4H,1,3,5H2,(H3,10,11,12,13)
InChIKeyINNXVIFTDRBJGB-UHFFFAOYSA-N
XLogP1.01
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine 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

3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine
CID 66275142
5-(4-chloro-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 62868181
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-amine
CID 28889917
3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1H-1,2,4-triazol-5-amine
CID 66277114
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80932610
[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine
CID 66455969
5-(6-phenylpyrazin-2-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 166201249
4-chloro-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)aniline
CID 115468438
4-cyclopentyl-3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazole-5-thione
CID 43645432
5-[6-(chloromethyl)pyrazin-2-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 66466630
5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-methylsulfanyl-1,2-thiazol-3-amine
CID 103362170
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-methylaniline
CID 62588261

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine?
The IUPAC name of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine (CID 66276232) is 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine.
What is the SMILES notation for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine?
The canonical SMILES for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine is Nc1nc(N2CCc3sccc3C2)n[nH]1.
What is the InChIKey of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine?
The InChIKey is INNXVIFTDRBJGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5S/c10-8-11-9(13-12-8)14-3-1-7-6(5-14)2-4-15-7/h2,4H,1,3,5H2,(H3,10,11,12,13).
What are the key properties of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine?
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine has a molecular weight of 221.29 g/mol, XLogP of 1.01, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1H-1,2,4-triazol-5-amine is sourced from PubChem (CID 66276232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).