2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione

C11H17FN2O2 — CID 74222349

IUPAC2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
SMILESCN1CCC2(CC1)CC(=O)N(CCF)C2=O
InChIInChI=1S/C11H17FN2O2/c1-13-5-2-11(3-6-13)8-9(15)14(7-4-12)10(11)16/h2-8H2,1H3
InChIKeyIPRAKAXWBDSOCW-UHFFFAOYSA-N
MW228.27 g/mol
LogP0.43
Rot. Bonds2

About 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione

2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione (PubChem CID 74222349) has the molecular formula C11H17FN2O2 and a molecular weight of 228.27 g/mol. Its IUPAC name is 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione.

Molecular Properties

Compound Name2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
PubChem CID74222349
Molecular FormulaC11H17FN2O2
Molecular Weight228.27 g/mol
Exact Mass228.13
IUPAC Name2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
SMILESCN1CCC2(CC1)CC(=O)N(CCF)C2=O
InChIInChI=1S/C11H17FN2O2/c1-13-5-2-11(3-6-13)8-9(15)14(7-4-12)10(11)16/h2-8H2,1H3
InChIKeyIPRAKAXWBDSOCW-UHFFFAOYSA-N
XLogP0.43
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The IUPAC name of 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione (CID 74222349) is 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione.
What is the SMILES notation for 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The canonical SMILES for 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione is CN1CCC2(CC1)CC(=O)N(CCF)C2=O.
What is the InChIKey of 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
The InChIKey is IPRAKAXWBDSOCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O2/c1-13-5-2-11(3-6-13)8-9(15)14(7-4-12)10(11)16/h2-8H2,1H3.
What are the key properties of 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione?
2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione has a molecular weight of 228.27 g/mol, XLogP of 0.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione is sourced from PubChem (CID 74222349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).