5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine

C8H11NOS — CID 83873936

IUPAC5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine
SMILESNCc1cc2c(s1)COCC2
InChIInChI=1S/C8H11NOS/c9-4-7-3-6-1-2-10-5-8(6)11-7/h3H,1-2,4-5,9H2
InChIKeyDZBXSGGEBBBNAI-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.28
Rot. Bonds1

About 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine

5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine (PubChem CID 83873936) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine.

Molecular Properties

Compound Name5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine
PubChem CID83873936
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine
SMILESNCc1cc2c(s1)COCC2
InChIInChI=1S/C8H11NOS/c9-4-7-3-6-1-2-10-5-8(6)11-7/h3H,1-2,4-5,9H2
InChIKeyDZBXSGGEBBBNAI-UHFFFAOYSA-N
XLogP1.28
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine?
The IUPAC name of 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine (CID 83873936) is 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine.
What is the SMILES notation for 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine?
The canonical SMILES for 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine is NCc1cc2c(s1)COCC2.
What is the InChIKey of 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine?
The InChIKey is DZBXSGGEBBBNAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c9-4-7-3-6-1-2-10-5-8(6)11-7/h3H,1-2,4-5,9H2.
What are the key properties of 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine?
5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine has a molecular weight of 169.25 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dihydro-4H-thieno[2,3-c]pyran-2-ylmethanamine is sourced from PubChem (CID 83873936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).