2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

C11H15N3S — CID 79677497

IUPAC2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESC1Cc2nc(N3CC4(CC4)C3)sc2CN1
InChIInChI=1S/C11H15N3S/c1-4-12-5-9-8(1)13-10(15-9)14-6-11(7-14)2-3-11/h12H,1-7H2
InChIKeyMCMDKRMHURPZFG-UHFFFAOYSA-N
MW221.33 g/mol
LogP1.39
Rot. Bonds1

About 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine

2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 79677497) has the molecular formula C11H15N3S and a molecular weight of 221.33 g/mol. Its IUPAC name is 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
PubChem CID79677497
Molecular FormulaC11H15N3S
Molecular Weight221.33 g/mol
Exact Mass221.10
IUPAC Name2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
SMILESC1Cc2nc(N3CC4(CC4)C3)sc2CN1
InChIInChI=1S/C11H15N3S/c1-4-12-5-9-8(1)13-10(15-9)14-6-11(7-14)2-3-11/h12H,1-7H2
InChIKeyMCMDKRMHURPZFG-UHFFFAOYSA-N
XLogP1.39
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine with MolForge

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Related Compounds

2-(2-azaspiro[3.6]decan-2-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 79677736
2-(3,3-diethylazetidin-1-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 79678678
2-(4-ethylpiperazin-1-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 58459811
1-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrrole-2,5-dione
CID 61349400
2-(3-butyl-4-deuteriopiperazin-1-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 175980414
2-(2,4,6-trifluorophenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 114016041
2-(2,6-dichlorophenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 62549980
4-(chloromethyl)-1-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrrolidin-2-one
CID 168509610
2-(1-adamantyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 55120633
2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 112681683
2-tert-butyl-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine;ethane;methane
CID 160631985
2-(2-azaspiro[3.3]heptan-2-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
CID 79671611

Frequently Asked Questions

What is the IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine (CID 79677497) is 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is C1Cc2nc(N3CC4(CC4)C3)sc2CN1.
What is the InChIKey of 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is MCMDKRMHURPZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3S/c1-4-12-5-9-8(1)13-10(15-9)14-6-11(7-14)2-3-11/h12H,1-7H2.
What are the key properties of 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine?
2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 221.33 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-azaspiro[2.3]hexan-5-yl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 79677497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).