N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide

C16H25N3O3S — CID 133140038

About N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide

N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide (PubChem CID 133140038) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide.

Molecular Properties

• Compound Name: N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide
• PubChem CID: 133140038
• Molecular Formula: C16H25N3O3S
• Molecular Weight: 339.46 g/mol
• Exact Mass: 339.16
• IUPAC Name: N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide
• SMILES: Cc1csc(CN2CC3(C2)OCCC3COCC(=O)N(C)C)n1
• InChI: InChI=1S/C16H25N3O3S/c1-12-9-23-14(17-12)6-19-10-16(11-19)13(4-5-22-16)7-21-8-15(20)18(2)3/h9,13H,4-8,10-11H2,1-3H3
• InChIKey: GCPUGHRYFMSHON-UHFFFAOYSA-N
• XLogP: 1.15
• TPSA: 54.90 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	339.46
LogP ≤ 5	1.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide?

The IUPAC name of N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide (CID 133140038) is N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide.

What is the SMILES notation for N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide?

The canonical SMILES for N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide is Cc1csc(CN2CC3(C2)OCCC3COCC(=O)N(C)C)n1.

What is the InChIKey of N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide?

The InChIKey is GCPUGHRYFMSHON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-12-9-23-14(17-12)6-19-10-16(11-19)13(4-5-22-16)7-21-8-15(20)18(2)3/h9,13H,4-8,10-11H2,1-3H3.

What are the key properties of N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide?

N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide has a molecular weight of 339.46 g/mol, XLogP of 1.15, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxa-2-azaspiro[3.4]octan-8-yl]methoxy]acetamide is sourced from PubChem (CID 133140038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).