5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine

C12H16N2S — CID 166928332

IUPAC5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine
SMILESCC(C)c1cc(C(C)C)c2ncsc2n1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10(8(3)4)14-12-11(9)13-6-15-12/h5-8H,1-4H3
InChIKeyHDGHCGRDCPKILU-UHFFFAOYSA-N
MW220.34 g/mol
LogP3.94
Rot. Bonds2

About 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine

5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 166928332) has the molecular formula C12H16N2S and a molecular weight of 220.34 g/mol. Its IUPAC name is 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine
PubChem CID166928332
Molecular FormulaC12H16N2S
Molecular Weight220.34 g/mol
Exact Mass220.10
IUPAC Name5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine
SMILESCC(C)c1cc(C(C)C)c2ncsc2n1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10(8(3)4)14-12-11(9)13-6-15-12/h5-8H,1-4H3
InChIKeyHDGHCGRDCPKILU-UHFFFAOYSA-N
XLogP3.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6,8-di(propan-2-yl)pyrido[3,2-d]pyrimidine
CID 130336662
2-methyl-5,7-di(propan-2-yl)-[1,3]oxazolo[5,4-b]pyridine
CID 134301977
ethane;2,4,5-tri(propan-2-yl)pyridine
CID 167652229
7-cyclopropyl-6-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
CID 155375459
7-bromo-5-chloro-[1,3]thiazolo[5,4-b]pyridine
CID 168966810
ethane;6-propan-2-yl-[1,3]thiazolo[5,4-c]pyridine
CID 153396887
5-methoxy-7-methyl-[1,3]thiazolo[5,4-b]pyridine
CID 151212590
7-chloro-5-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 89272586
5,7-ditert-butyl-[1,3]thiazolo[5,4-b]pyridine
CID 159647449
5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 83828889
7-methoxy-5-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 151063826
6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
CID 118410775

Frequently Asked Questions

What is the IUPAC name of 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine (CID 166928332) is 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine is CC(C)c1cc(C(C)C)c2ncsc2n1.
What is the InChIKey of 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is HDGHCGRDCPKILU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S/c1-7(2)9-5-10(8(3)4)14-12-11(9)13-6-15-12/h5-8H,1-4H3.
What are the key properties of 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine?
5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 220.34 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-di(propan-2-yl)-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 166928332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).