(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine

C8H11NS — CID 92981428

IUPAC(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine
SMILESN[C@@H]1CCCc2ccsc21
InChIInChI=1S/C8H11NS/c9-7-3-1-2-6-4-5-10-8(6)7/h4-5,7H,1-3,9H2/t7-/m1/s1
InChIKeyZLAICQWCSUMUIX-SSDOTTSWSA-N
MW153.25 g/mol
LogP2.08
Rot. Bonds

About (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine

(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine (PubChem CID 92981428) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine.

Molecular Properties

Compound Name(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine
PubChem CID92981428
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine
SMILESN[C@@H]1CCCc2ccsc21
InChIInChI=1S/C8H11NS/c9-7-3-1-2-6-4-5-10-8(6)7/h4-5,7H,1-3,9H2/t7-/m1/s1
InChIKeyZLAICQWCSUMUIX-SSDOTTSWSA-N
XLogP2.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine 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 (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine?
The IUPAC name of (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine (CID 92981428) is (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine.
What is the SMILES notation for (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine?
The canonical SMILES for (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine is N[C@@H]1CCCc2ccsc21.
What is the InChIKey of (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine?
The InChIKey is ZLAICQWCSUMUIX-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H11NS/c9-7-3-1-2-6-4-5-10-8(6)7/h4-5,7H,1-3,9H2/t7-/m1/s1.
What are the key properties of (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine?
(7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine has a molecular weight of 153.25 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-4,5,6,7-tetrahydro-1-benzothiophen-7-amine is sourced from PubChem (CID 92981428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).