2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide

C17H26FN3O3 — CID 131684190

IUPAC2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1C(=O)CCC12CCN(C(=O)C1(F)CCC1)CC2
InChIInChI=1S/C17H26FN3O3/c1-19(2)14(23)12-21-13(22)4-7-16(21)8-10-20(11-9-16)15(24)17(18)5-3-6-17/h3-12H2,1-2H3
InChIKeyUIMCCAVGWNSAKF-UHFFFAOYSA-N
MW339.41 g/mol
LogP0.95
Rot. Bonds3

About 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide

2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide (PubChem CID 131684190) has the molecular formula C17H26FN3O3 and a molecular weight of 339.41 g/mol. Its IUPAC name is 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide
PubChem CID131684190
Molecular FormulaC17H26FN3O3
Molecular Weight339.41 g/mol
Exact Mass339.20
IUPAC Name2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN1C(=O)CCC12CCN(C(=O)C1(F)CCC1)CC2
InChIInChI=1S/C17H26FN3O3/c1-19(2)14(23)12-21-13(22)4-7-16(21)8-10-20(11-9-16)15(24)17(18)5-3-6-17/h3-12H2,1-2H3
InChIKeyUIMCCAVGWNSAKF-UHFFFAOYSA-N
XLogP0.95
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.41
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide 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 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide (CID 131684190) is 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide is CN(C)C(=O)CN1C(=O)CCC12CCN(C(=O)C1(F)CCC1)CC2.
What is the InChIKey of 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide?
The InChIKey is UIMCCAVGWNSAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN3O3/c1-19(2)14(23)12-21-13(22)4-7-16(21)8-10-20(11-9-16)15(24)17(18)5-3-6-17/h3-12H2,1-2H3.
What are the key properties of 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide?
2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide has a molecular weight of 339.41 g/mol, XLogP of 0.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(1-fluorocyclobutanecarbonyl)-2-oxo-1,8-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 131684190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).