2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine

C9H11NS — CID 175259757

IUPAC2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine
SMILESCc1sc2c(c1C)C=NCC2
InChIInChI=1S/C9H11NS/c1-6-7(2)11-9-3-4-10-5-8(6)9/h5H,3-4H2,1-2H3
InChIKeyBNYVPCZHIZQLOE-UHFFFAOYSA-N
MW165.26 g/mol
LogP2.34
Rot. Bonds

About 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine

2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine (PubChem CID 175259757) has the molecular formula C9H11NS and a molecular weight of 165.26 g/mol. Its IUPAC name is 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine
PubChem CID175259757
Molecular FormulaC9H11NS
Molecular Weight165.26 g/mol
Exact Mass165.06
IUPAC Name2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine
SMILESCc1sc2c(c1C)C=NCC2
InChIInChI=1S/C9H11NS/c1-6-7(2)11-9-3-4-10-5-8(6)9/h5H,3-4H2,1-2H3
InChIKeyBNYVPCZHIZQLOE-UHFFFAOYSA-N
XLogP2.34
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.26
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 59663091
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CID 90364000
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CID 90364009
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CID 123505163
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CID 123867742
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CID 138605380
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CID 140995213
CID 140995213

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine?
The IUPAC name of 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine (CID 175259757) is 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine.
What is the SMILES notation for 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine?
The canonical SMILES for 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine is Cc1sc2c(c1C)C=NCC2.
What is the InChIKey of 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine?
The InChIKey is BNYVPCZHIZQLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NS/c1-6-7(2)11-9-3-4-10-5-8(6)9/h5H,3-4H2,1-2H3.
What are the key properties of 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine?
2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine has a molecular weight of 165.26 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6,7-dihydrothieno[3,2-c]pyridine is sourced from PubChem (CID 175259757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).