4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine

C13H17NS — CID 58519644

IUPAC4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine
SMILESCc1nc(C)c2cc(C(C)C)sc2c1C
InChIInChI=1S/C13H17NS/c1-7(2)12-6-11-10(5)14-9(4)8(3)13(11)15-12/h6-7H,1-5H3
InChIKeyTWUDYGDQFIDNOG-UHFFFAOYSA-N
MW219.35 g/mol
LogP4.34
Rot. Bonds1

About 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine

4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine (PubChem CID 58519644) has the molecular formula C13H17NS and a molecular weight of 219.35 g/mol. Its IUPAC name is 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine.

Molecular Properties

Compound Name4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine
PubChem CID58519644
Molecular FormulaC13H17NS
Molecular Weight219.35 g/mol
Exact Mass219.11
IUPAC Name4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine
SMILESCc1nc(C)c2cc(C(C)C)sc2c1C
InChIInChI=1S/C13H17NS/c1-7(2)12-6-11-10(5)14-9(4)8(3)13(11)15-12/h6-7H,1-5H3
InChIKeyTWUDYGDQFIDNOG-UHFFFAOYSA-N
XLogP4.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethyl-3-methyl-benzo[4,5]thieno[2,3-c]pyridine
CID 12861807
5-Phenylthieno[3,2-b]pyridine
CID 24747710
2-(2-(Benzo[b]thiophen-2-yl)ethynyl)-6-methylpyridine
CID 44416005
rac-2-(3-(1-(6-fluoropyridin-2-yl)ethyl)benzo[b]thiophen-2-yl)-N,N-dimethylethanamine
CID 46884119
1,3-Dimethyl-benzo[4,5]thieno[2,3-c]pyridine
CID 12861805
2-Ethyl-1,3-dimethyl-benzothiopheno[2,3-c]pyridin-2-ium;iodide
CID 836727
2-Phenyl-6-(2-thienyl)pyridine
CID 15423030
2-Butylsulfinyl-6-phenylthieno[2,3-b]pyridine
CID 118058998
4-Chloro-6-methylthieno(3,2-c)pyridine
CID 18691213
2,6-Di(thiophen-3-yl)pyridine
CID 901578
2-Thiophen-2-yl-6-thiophen-3-ylpyridine
CID 24873912
2-Phenyl-6-thiophen-3-ylpyridine
CID 24873973

Frequently Asked Questions

What is the IUPAC name of 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine?
The IUPAC name of 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine (CID 58519644) is 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine.
What is the SMILES notation for 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine?
The canonical SMILES for 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine is Cc1nc(C)c2cc(C(C)C)sc2c1C.
What is the InChIKey of 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine?
The InChIKey is TWUDYGDQFIDNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NS/c1-7(2)12-6-11-10(5)14-9(4)8(3)13(11)15-12/h6-7H,1-5H3.
What are the key properties of 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine?
4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine has a molecular weight of 219.35 g/mol, XLogP of 4.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6,7-trimethyl-2-propan-2-ylthieno[3,2-c]pyridine is sourced from PubChem (CID 58519644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).