5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole

C8H10N2S — CID 11550062

IUPAC5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole
SMILESc1cc(C2CC23CNC3)sn1
InChIInChI=1S/C8H10N2S/c1-2-10-11-7(1)6-3-8(6)4-9-5-8/h1-2,6,9H,3-5H2
InChIKeyAVWHNYAYSYIVJI-UHFFFAOYSA-N
MW166.25 g/mol
LogP1.22
Rot. Bonds1

About 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole

5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole (PubChem CID 11550062) has the molecular formula C8H10N2S and a molecular weight of 166.25 g/mol. Its IUPAC name is 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole.

Molecular Properties

Compound Name5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole
PubChem CID11550062
Molecular FormulaC8H10N2S
Molecular Weight166.25 g/mol
Exact Mass166.06
IUPAC Name5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole
SMILESc1cc(C2CC23CNC3)sn1
InChIInChI=1S/C8H10N2S/c1-2-10-11-7(1)6-3-8(6)4-9-5-8/h1-2,6,9H,3-5H2
InChIKeyAVWHNYAYSYIVJI-UHFFFAOYSA-N
XLogP1.22
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.25
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole?
The IUPAC name of 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole (CID 11550062) is 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole.
What is the SMILES notation for 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole?
The canonical SMILES for 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole is c1cc(C2CC23CNC3)sn1.
What is the InChIKey of 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole?
The InChIKey is AVWHNYAYSYIVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2S/c1-2-10-11-7(1)6-3-8(6)4-9-5-8/h1-2,6,9H,3-5H2.
What are the key properties of 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole?
5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole has a molecular weight of 166.25 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-azaspiro[2.3]hexan-2-yl)-1,2-thiazole is sourced from PubChem (CID 11550062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).