7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine

C11H14N2S — CID 175626724

IUPAC7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)(C)Cc1cncc2ncsc12
InChIInChI=1S/C11H14N2S/c1-11(2,3)4-8-5-12-6-9-10(8)14-7-13-9/h5-7H,4H2,1-3H3
InChIKeyHFRIUECGGQLKIX-UHFFFAOYSA-N
MW206.31 g/mol
LogP3.28
Rot. Bonds1

About 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine

7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 175626724) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine
PubChem CID175626724
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)(C)Cc1cncc2ncsc12
InChIInChI=1S/C11H14N2S/c1-11(2,3)4-8-5-12-6-9-10(8)14-7-13-9/h5-7H,4H2,1-3H3
InChIKeyHFRIUECGGQLKIX-UHFFFAOYSA-N
XLogP3.28
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine (CID 175626724) is 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine is CC(C)(C)Cc1cncc2ncsc12.
What is the InChIKey of 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is HFRIUECGGQLKIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-11(2,3)4-8-5-12-6-9-10(8)14-7-13-9/h5-7H,4H2,1-3H3.
What are the key properties of 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine?
7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 206.31 g/mol, XLogP of 3.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,2-dimethylpropyl)-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 175626724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).