5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride

C6H8ClNS — CID 71743930

IUPAC5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride
SMILESCl.c1cc2c(s1)CNC2
InChIInChI=1S/C6H7NS.ClH/c1-2-8-6-4-7-3-5(1)6;/h1-2,7H,3-4H2;1H
InChIKeyKREVWSYVKHGBMB-UHFFFAOYSA-N
MW161.66 g/mol
LogP1.77
Rot. Bonds

About 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride

5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride (PubChem CID 71743930) has the molecular formula C6H8ClNS and a molecular weight of 161.66 g/mol. Its IUPAC name is 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride.

Molecular Properties

Compound Name5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride
PubChem CID71743930
Molecular FormulaC6H8ClNS
Molecular Weight161.66 g/mol
Exact Mass161.01
IUPAC Name5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride
SMILESCl.c1cc2c(s1)CNC2
InChIInChI=1S/C6H7NS.ClH/c1-2-8-6-4-7-3-5(1)6;/h1-2,7H,3-4H2;1H
InChIKeyKREVWSYVKHGBMB-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.66
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride?
The IUPAC name of 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride (CID 71743930) is 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride.
What is the SMILES notation for 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride?
The canonical SMILES for 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride is Cl.c1cc2c(s1)CNC2.
What is the InChIKey of 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride?
The InChIKey is KREVWSYVKHGBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NS.ClH/c1-2-8-6-4-7-3-5(1)6;/h1-2,7H,3-4H2;1H.
What are the key properties of 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride?
5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride has a molecular weight of 161.66 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-thieno[2,3-c]pyrrole;hydrochloride is sourced from PubChem (CID 71743930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).