2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione

C8H13N3O2 — CID 130597066

IUPAC2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione
SMILESCN1CCC2(C1)NCC(=O)NC2=O
InChIInChI=1S/C8H13N3O2/c1-11-3-2-8(5-11)7(13)10-6(12)4-9-8/h9H,2-5H2,1H3,(H,10,12,13)
InChIKeyRULJPBUXZTVLOY-UHFFFAOYSA-N
MW183.21 g/mol
LogP-1.69
Rot. Bonds

About 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione

2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione (PubChem CID 130597066) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione.

Molecular Properties

Compound Name2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione
PubChem CID130597066
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione
SMILESCN1CCC2(C1)NCC(=O)NC2=O
InChIInChI=1S/C8H13N3O2/c1-11-3-2-8(5-11)7(13)10-6(12)4-9-8/h9H,2-5H2,1H3,(H,10,12,13)
InChIKeyRULJPBUXZTVLOY-UHFFFAOYSA-N
XLogP-1.69
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-1.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

7-methyl-2-sulfanylidene-1,3,7-triazaspiro[4.4]nonan-4-one
CID 82996204
tert-butyl 8,10-dioxo-2,6,9-triazaspiro[4.5]decane-2-carboxylate
CID 130941465
7-methyl-1,7-diazaspiro[4.4]nonane-2,4-dione
CID 164972887
tert-butyl 3,5-dioxo-1,4,9-triazaspiro[5.5]undecane-9-carboxylate
CID 130597040
8-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione;hydrate
CID 154701034
2-iodo-9-methyl-2,6,9-triazaspiro[4.5]decan-1-one
CID 170035585
9-methyl-1,3,9-triazaspiro[4.5]decane-2,4-dione;molecular hydrogen
CID 177033435
9-methyl-2,9-diazaspiro[4.6]undecane-1,3-dione
CID 65071381
8-methyl-1,8-diazaspiro[3.5]nonan-2-one
CID 169184407
3,8-dimethyl-1,8-diazaspiro[4.5]decan-4-one
CID 150167355
6-methyl-1,6-diazaspiro[2.4]heptane
CID 148820818
8-methyl-1,8-diazaspiro[4.5]decan-3-one;hydrochloride
CID 115023776

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione?
The IUPAC name of 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione (CID 130597066) is 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione.
What is the SMILES notation for 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione?
The canonical SMILES for 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione is CN1CCC2(C1)NCC(=O)NC2=O.
What is the InChIKey of 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione?
The InChIKey is RULJPBUXZTVLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-11-3-2-8(5-11)7(13)10-6(12)4-9-8/h9H,2-5H2,1H3,(H,10,12,13).
What are the key properties of 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione?
2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione has a molecular weight of 183.21 g/mol, XLogP of -1.69, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2,6,9-triazaspiro[4.5]decane-8,10-dione is sourced from PubChem (CID 130597066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).