(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone

C16H24N2O2S — CID 56879881

IUPAC(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone
SMILESCc1nc(C(C)C)sc1C(=O)N1CCC2(CCCO2)CC1
InChIInChI=1S/C16H24N2O2S/c1-11(2)14-17-12(3)13(21-14)15(19)18-8-6-16(7-9-18)5-4-10-20-16/h11H,4-10H2,1-3H3
InChIKeyNABBBWXZDYQUKD-UHFFFAOYSA-N
MW308.45 g/mol
LogP3.36
Rot. Bonds2

About (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone

(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone (PubChem CID 56879881) has the molecular formula C16H24N2O2S and a molecular weight of 308.45 g/mol. Its IUPAC name is (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone.

Molecular Properties

Compound Name(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone
PubChem CID56879881
Molecular FormulaC16H24N2O2S
Molecular Weight308.45 g/mol
Exact Mass308.16
IUPAC Name(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone
SMILESCc1nc(C(C)C)sc1C(=O)N1CCC2(CCCO2)CC1
InChIInChI=1S/C16H24N2O2S/c1-11(2)14-17-12(3)13(21-14)15(19)18-8-6-16(7-9-18)5-4-10-20-16/h11H,4-10H2,1-3H3
InChIKeyNABBBWXZDYQUKD-UHFFFAOYSA-N
XLogP3.36
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.45
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone?
The IUPAC name of (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone (CID 56879881) is (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone.
What is the SMILES notation for (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone?
The canonical SMILES for (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone is Cc1nc(C(C)C)sc1C(=O)N1CCC2(CCCO2)CC1.
What is the InChIKey of (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone?
The InChIKey is NABBBWXZDYQUKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2S/c1-11(2)14-17-12(3)13(21-14)15(19)18-8-6-16(7-9-18)5-4-10-20-16/h11H,4-10H2,1-3H3.
What are the key properties of (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone?
(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone has a molecular weight of 308.45 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)-(1-oxa-8-azaspiro[4.5]decan-8-yl)methanone is sourced from PubChem (CID 56879881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).