5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole

C10H14N2S — CID 11579275

IUPAC5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole
SMILESc1cc(C2CCC3(CNC3)C2)sn1
InChIInChI=1S/C10H14N2S/c1-3-10(6-11-7-10)5-8(1)9-2-4-12-13-9/h2,4,8,11H,1,3,5-7H2
InChIKeyIZPBUTUOQKORII-UHFFFAOYSA-N
MW194.30 g/mol
LogP2.00
Rot. Bonds1

About 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole

5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole (PubChem CID 11579275) has the molecular formula C10H14N2S and a molecular weight of 194.30 g/mol. Its IUPAC name is 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole.

Molecular Properties

Compound Name5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole
PubChem CID11579275
Molecular FormulaC10H14N2S
Molecular Weight194.30 g/mol
Exact Mass194.09
IUPAC Name5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole
SMILESc1cc(C2CCC3(CNC3)C2)sn1
InChIInChI=1S/C10H14N2S/c1-3-10(6-11-7-10)5-8(1)9-2-4-12-13-9/h2,4,8,11H,1,3,5-7H2
InChIKeyIZPBUTUOQKORII-UHFFFAOYSA-N
XLogP2.00
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole?
The IUPAC name of 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole (CID 11579275) is 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole.
What is the SMILES notation for 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole?
The canonical SMILES for 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole is c1cc(C2CCC3(CNC3)C2)sn1.
What is the InChIKey of 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole?
The InChIKey is IZPBUTUOQKORII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2S/c1-3-10(6-11-7-10)5-8(1)9-2-4-12-13-9/h2,4,8,11H,1,3,5-7H2.
What are the key properties of 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole?
5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole has a molecular weight of 194.30 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-azaspiro[3.4]octan-6-yl)-1,2-thiazole is sourced from PubChem (CID 11579275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).