9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide

C17H18N4O3S — CID 167783352

IUPAC9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide
SMILESO=C1CC2(CCOC2)C(C(=O)Nc2nc(-c3ccccn3)cs2)CN1
InChIInChI=1S/C17H18N4O3S/c22-14-7-17(4-6-24-10-17)11(8-19-14)15(23)21-16-20-13(9-25-16)12-3-1-2-5-18-12/h1-3,5,9,11H,4,6-8,10H2,(H,19,22)(H,20,21,23)
InChIKeyUAJRQXLDWBMOEF-UHFFFAOYSA-N
MW358.42 g/mol
LogP1.69
Rot. Bonds3

About 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide

9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide (PubChem CID 167783352) has the molecular formula C17H18N4O3S and a molecular weight of 358.42 g/mol. Its IUPAC name is 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide.

Molecular Properties

Compound Name9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide
PubChem CID167783352
Molecular FormulaC17H18N4O3S
Molecular Weight358.42 g/mol
Exact Mass358.11
IUPAC Name9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide
SMILESO=C1CC2(CCOC2)C(C(=O)Nc2nc(-c3ccccn3)cs2)CN1
InChIInChI=1S/C17H18N4O3S/c22-14-7-17(4-6-24-10-17)11(8-19-14)15(23)21-16-20-13(9-25-16)12-3-1-2-5-18-12/h1-3,5,9,11H,4,6-8,10H2,(H,19,22)(H,20,21,23)
InChIKeyUAJRQXLDWBMOEF-UHFFFAOYSA-N
XLogP1.69
TPSA93.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

oxolan-3-yl-[(1S,5R)-6-[[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]methanone
CID 46927903
2-methyl-1-[(1S,5R)-6-[[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]propan-1-one
CID 49862155
oxolan-2-yl-[(1S,5R)-6-[[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]methanone
CID 49862290
oxan-4-yl-[(1R,5S)-6-[[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]methanone
CID 49862336
4-methyl-2-[3-(oxan-2-yl)-2-oxoimidazolidin-1-yl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-5-carboxamide
CID 73213106
1-(2,3-dimethylcyclohexyl)-5-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
CID 16288845
1-[(1S,5R)-6-[[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]ethanone
CID 46927904
8-Oxa-2-azaspiro[4.5]decan-2-yl-[2-(pyridin-2-ylmethylamino)-1,3-thiazol-5-yl]methanone
CID 178307127
5-oxo-N-(4-(2-oxo-2-(4-(pyridin-2-yl)piperazin-1-yl)ethyl)thiazol-2-yl)pyrrolidine-2-carboxamide
CID 16881470
Ethyl 4-((4-(2-oxo-2-((pyridin-3-ylmethyl)amino)ethyl)thiazol-2-yl)carbamoyl)piperazine-1-carboxylate
CID 42390637
5-oxo-N-(4-(2-oxo-2-((pyridin-3-ylmethyl)amino)ethyl)thiazol-2-yl)pyrrolidine-2-carboxamide
CID 44048828
N-[4-[2-oxo-2-(4-pyrrolidin-1-ylpiperidin-1-yl)ethyl]-1,3-thiazol-2-yl]-3-pyridin-3-ylpropanamide
CID 134384645

Frequently Asked Questions

What is the IUPAC name of 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide?
The IUPAC name of 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide (CID 167783352) is 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide.
What is the SMILES notation for 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide?
The canonical SMILES for 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide is O=C1CC2(CCOC2)C(C(=O)Nc2nc(-c3ccccn3)cs2)CN1.
What is the InChIKey of 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide?
The InChIKey is UAJRQXLDWBMOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3S/c22-14-7-17(4-6-24-10-17)11(8-19-14)15(23)21-16-20-13(9-25-16)12-3-1-2-5-18-12/h1-3,5,9,11H,4,6-8,10H2,(H,19,22)(H,20,21,23).
What are the key properties of 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide?
9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide has a molecular weight of 358.42 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-2-oxa-8-azaspiro[4.5]decane-6-carboxamide is sourced from PubChem (CID 167783352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).