5,7-diazaspiro[2.5]octane-6,8-dione

C6H8N2O2 — CID 115451832

IUPAC5,7-diazaspiro[2.5]octane-6,8-dione
SMILESO=C1NCC2(CC2)C(=O)N1
InChIInChI=1S/C6H8N2O2/c9-4-6(1-2-6)3-7-5(10)8-4/h1-3H2,(H2,7,8,9,10)
InChIKeySOMBXRBIJFTVIY-UHFFFAOYSA-N
MW140.14 g/mol
LogP-0.39
Rot. Bonds

About 5,7-diazaspiro[2.5]octane-6,8-dione

5,7-diazaspiro[2.5]octane-6,8-dione (PubChem CID 115451832) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 5,7-diazaspiro[2.5]octane-6,8-dione.

Molecular Properties

Compound Name5,7-diazaspiro[2.5]octane-6,8-dione
PubChem CID115451832
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name5,7-diazaspiro[2.5]octane-6,8-dione
SMILESO=C1NCC2(CC2)C(=O)N1
InChIInChI=1S/C6H8N2O2/c9-4-6(1-2-6)3-7-5(10)8-4/h1-3H2,(H2,7,8,9,10)
InChIKeySOMBXRBIJFTVIY-UHFFFAOYSA-N
XLogP-0.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-diazaspiro[2.5]octane-6,8-dione?
The IUPAC name of 5,7-diazaspiro[2.5]octane-6,8-dione (CID 115451832) is 5,7-diazaspiro[2.5]octane-6,8-dione.
What is the SMILES notation for 5,7-diazaspiro[2.5]octane-6,8-dione?
The canonical SMILES for 5,7-diazaspiro[2.5]octane-6,8-dione is O=C1NCC2(CC2)C(=O)N1.
What is the InChIKey of 5,7-diazaspiro[2.5]octane-6,8-dione?
The InChIKey is SOMBXRBIJFTVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c9-4-6(1-2-6)3-7-5(10)8-4/h1-3H2,(H2,7,8,9,10).
What are the key properties of 5,7-diazaspiro[2.5]octane-6,8-dione?
5,7-diazaspiro[2.5]octane-6,8-dione has a molecular weight of 140.14 g/mol, XLogP of -0.39, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-diazaspiro[2.5]octane-6,8-dione is sourced from PubChem (CID 115451832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).