2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone

C14H20N2O2S — CID 86768657

IUPAC2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone
SMILESCc1nc(CC(=O)N2CCC3(CCOCC3)C2)cs1
InChIInChI=1S/C14H20N2O2S/c1-11-15-12(9-19-11)8-13(17)16-5-2-14(10-16)3-6-18-7-4-14/h9H,2-8,10H2,1H3
InChIKeyUJCBUHDRSCWWJC-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.02
Rot. Bonds2

About 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone

2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone (PubChem CID 86768657) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone.

Molecular Properties

Compound Name2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone
PubChem CID86768657
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone
SMILESCc1nc(CC(=O)N2CCC3(CCOCC3)C2)cs1
InChIInChI=1S/C14H20N2O2S/c1-11-15-12(9-19-11)8-13(17)16-5-2-14(10-16)3-6-18-7-4-14/h9H,2-8,10H2,1H3
InChIKeyUJCBUHDRSCWWJC-UHFFFAOYSA-N
XLogP2.02
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone 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

4-[[[2-(2-Ethyl-1,3-thiazol-4-yl)acetyl]amino]methyl]oxane-4-carboxamide
CID 56798712
2-(2-Ethyl-1,3-thiazol-4-yl)-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethanone
CID 56819149
8-[(2-Methyl-1,3-thiazol-4-yl)acetyl]-2-(tetrahydro-2-furanylmethyl)-2,8-diazaspiro[4.5]decan-3-one
CID 72873979
2-(3-Methoxypropyl)-8-[(2-methyl-1,3-thiazol-4-yl)acetyl]-2,8-diazaspiro[4.5]decan-3-one
CID 72886342
N-(3-butoxy-2,2-dimethylcyclobutyl)-2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide
CID 72109744
1-(2,2-Dimethylpyrrolidin-1-yl)-2-(2-ethyl-1,3-thiazol-4-yl)ethanone
CID 86768821
1-(7-Acetyl-3-oxa-7,10-diazaspiro[5.6]dodecan-10-yl)-2-(2-ethyl-1,3-thiazol-4-yl)ethanone
CID 164636963
2-(2-tert-butyl-1,3-thiazol-4-yl)-N-(oxan-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 102559435
1-[(1R,5S)-6-(hydroxymethyl)-3-azabicyclo[3.1.0]hexan-3-yl]-2-[2-(3,3,3-trifluoropropyl)-1,3-thiazol-4-yl]ethanone
CID 136584846
1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 66261830
1-[3-(Hydroxymethyl)piperidin-1-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 43403332
Ethyl 1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]piperidine-4-carboxylate
CID 43404231

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone?
The IUPAC name of 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone (CID 86768657) is 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone.
What is the SMILES notation for 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone?
The canonical SMILES for 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone is Cc1nc(CC(=O)N2CCC3(CCOCC3)C2)cs1.
What is the InChIKey of 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone?
The InChIKey is UJCBUHDRSCWWJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2S/c1-11-15-12(9-19-11)8-13(17)16-5-2-14(10-16)3-6-18-7-4-14/h9H,2-8,10H2,1H3.
What are the key properties of 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone?
2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone has a molecular weight of 280.39 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1,3-thiazol-4-yl)-1-(8-oxa-2-azaspiro[4.5]decan-2-yl)ethanone is sourced from PubChem (CID 86768657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).