10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione

C12H19FN2O2 — CID 80698061

IUPAC10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CC(=O)NC2(CCCC2)C(=O)N1CCF
InChIInChI=1S/C12H19FN2O2/c1-9-8-10(16)14-12(4-2-3-5-12)11(17)15(9)7-6-13/h9H,2-8H2,1H3,(H,14,16)
InChIKeyOVLUETFUWOVYBS-UHFFFAOYSA-N
MW242.29 g/mol
LogP1.01
Rot. Bonds2

About 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione

10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione (PubChem CID 80698061) has the molecular formula C12H19FN2O2 and a molecular weight of 242.29 g/mol. Its IUPAC name is 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione.

Molecular Properties

Compound Name10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
PubChem CID80698061
Molecular FormulaC12H19FN2O2
Molecular Weight242.29 g/mol
Exact Mass242.14
IUPAC Name10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione
SMILESCC1CC(=O)NC2(CCCC2)C(=O)N1CCF
InChIInChI=1S/C12H19FN2O2/c1-9-8-10(16)14-12(4-2-3-5-12)11(17)15(9)7-6-13/h9H,2-8H2,1H3,(H,14,16)
InChIKeyOVLUETFUWOVYBS-UHFFFAOYSA-N
XLogP1.01
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The IUPAC name of 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione (CID 80698061) is 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione.
What is the SMILES notation for 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The canonical SMILES for 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione is CC1CC(=O)NC2(CCCC2)C(=O)N1CCF.
What is the InChIKey of 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
The InChIKey is OVLUETFUWOVYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN2O2/c1-9-8-10(16)14-12(4-2-3-5-12)11(17)15(9)7-6-13/h9H,2-8H2,1H3,(H,14,16).
What are the key properties of 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione?
10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione has a molecular weight of 242.29 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2-fluoroethyl)-9-methyl-6,10-diazaspiro[4.6]undecane-7,11-dione is sourced from PubChem (CID 80698061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).