6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

C10H17N3O2 — CID 607189

IUPAC6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCC1CC2(NC(=O)NC2=O)C(C)CN1C
InChIInChI=1S/C10H17N3O2/c1-6-5-13(3)7(2)4-10(6)8(14)11-9(15)12-10/h6-7H,4-5H2,1-3H3,(H2,11,12,14,15)
InChIKeyPTZHSPUSMKLXAU-UHFFFAOYSA-N
MW211.26 g/mol
LogP-0.08
Rot. Bonds

About 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (PubChem CID 607189) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
PubChem CID607189
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCC1CC2(NC(=O)NC2=O)C(C)CN1C
InChIInChI=1S/C10H17N3O2/c1-6-5-13(3)7(2)4-10(6)8(14)11-9(15)12-10/h6-7H,4-5H2,1-3H3,(H2,11,12,14,15)
InChIKeyPTZHSPUSMKLXAU-UHFFFAOYSA-N
XLogP-0.08
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CID 607189) is 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is CC1CC2(NC(=O)NC2=O)C(C)CN1C.
What is the InChIKey of 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is PTZHSPUSMKLXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-6-5-13(3)7(2)4-10(6)8(14)11-9(15)12-10/h6-7H,4-5H2,1-3H3,(H2,11,12,14,15).
What are the key properties of 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 211.26 g/mol, XLogP of -0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8,9-trimethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 607189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).