5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine

C9H13NS — CID 57423980

IUPAC5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine
SMILESCC1Cc2ccsc2CN1C
InChIInChI=1S/C9H13NS/c1-7-5-8-3-4-11-9(8)6-10(7)2/h3-4,7H,5-6H2,1-2H3
InChIKeyAADGNZUWSQDYCC-UHFFFAOYSA-N
MW167.28 g/mol
LogP2.12
Rot. Bonds

About 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine

5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine (PubChem CID 57423980) has the molecular formula C9H13NS and a molecular weight of 167.28 g/mol. Its IUPAC name is 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine.

Molecular Properties

Compound Name5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine
PubChem CID57423980
Molecular FormulaC9H13NS
Molecular Weight167.28 g/mol
Exact Mass167.08
IUPAC Name5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine
SMILESCC1Cc2ccsc2CN1C
InChIInChI=1S/C9H13NS/c1-7-5-8-3-4-11-9(8)6-10(7)2/h3-4,7H,5-6H2,1-2H3
InChIKeyAADGNZUWSQDYCC-UHFFFAOYSA-N
XLogP2.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.28
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine?
The IUPAC name of 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine (CID 57423980) is 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine.
What is the SMILES notation for 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine?
The canonical SMILES for 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine is CC1Cc2ccsc2CN1C.
What is the InChIKey of 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine?
The InChIKey is AADGNZUWSQDYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NS/c1-7-5-8-3-4-11-9(8)6-10(7)2/h3-4,7H,5-6H2,1-2H3.
What are the key properties of 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine?
5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine has a molecular weight of 167.28 g/mol, XLogP of 2.12, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine is sourced from PubChem (CID 57423980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).