8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione

C12H20N2O2 — CID 64887606

IUPAC8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1C(=O)NC2(CCCC2)C(=O)N1CC
InChIInChI=1S/C12H20N2O2/c1-3-9-10(15)13-12(7-5-6-8-12)11(16)14(9)4-2/h9H,3-8H2,1-2H3,(H,13,15)
InChIKeyMFMXSGWOIUNDLS-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.06
Rot. Bonds2

About 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione

8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64887606) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64887606
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1C(=O)NC2(CCCC2)C(=O)N1CC
InChIInChI=1S/C12H20N2O2/c1-3-9-10(15)13-12(7-5-6-8-12)11(16)14(9)4-2/h9H,3-8H2,1-2H3,(H,13,15)
InChIKeyMFMXSGWOIUNDLS-UHFFFAOYSA-N
XLogP1.06
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64887606) is 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione is CCC1C(=O)NC2(CCCC2)C(=O)N1CC.
What is the InChIKey of 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is MFMXSGWOIUNDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-9-10(15)13-12(7-5-6-8-12)11(16)14(9)4-2/h9H,3-8H2,1-2H3,(H,13,15).
What are the key properties of 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 224.30 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64887606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).