6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C11H17FN2O2 — CID 80697288

IUPAC6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1NC(=O)C2(CCCC2)N(CCF)C1=O
InChIInChI=1S/C11H17FN2O2/c1-8-9(15)14(7-6-12)11(10(16)13-8)4-2-3-5-11/h8H,2-7H2,1H3,(H,13,16)
InChIKeyZMWVKZKZPMBMOU-UHFFFAOYSA-N
MW228.27 g/mol
LogP0.62
Rot. Bonds2

About 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 80697288) has the molecular formula C11H17FN2O2 and a molecular weight of 228.27 g/mol. Its IUPAC name is 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID80697288
Molecular FormulaC11H17FN2O2
Molecular Weight228.27 g/mol
Exact Mass228.13
IUPAC Name6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1NC(=O)C2(CCCC2)N(CCF)C1=O
InChIInChI=1S/C11H17FN2O2/c1-8-9(15)14(7-6-12)11(10(16)13-8)4-2-3-5-11/h8H,2-7H2,1H3,(H,13,16)
InChIKeyZMWVKZKZPMBMOU-UHFFFAOYSA-N
XLogP0.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 80697288) is 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is CC1NC(=O)C2(CCCC2)N(CCF)C1=O.
What is the InChIKey of 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is ZMWVKZKZPMBMOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2O2/c1-8-9(15)14(7-6-12)11(10(16)13-8)4-2-3-5-11/h8H,2-7H2,1H3,(H,13,16).
What are the key properties of 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 228.27 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 80697288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).