7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

C11H19N3O2 — CID 1268066

IUPAC7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCC1(C)CC2(CC(C)(C)N1)NC(=O)NC2=O
InChIInChI=1S/C11H19N3O2/c1-9(2)5-11(6-10(3,4)14-9)7(15)12-8(16)13-11/h14H,5-6H2,1-4H3,(H2,12,13,15,16)
InChIKeyPNJCQCUNRRANAF-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.51
Rot. Bonds

About 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (PubChem CID 1268066) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
PubChem CID1268066
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCC1(C)CC2(CC(C)(C)N1)NC(=O)NC2=O
InChIInChI=1S/C11H19N3O2/c1-9(2)5-11(6-10(3,4)14-9)7(15)12-8(16)13-11/h14H,5-6H2,1-4H3,(H2,12,13,15,16)
InChIKeyPNJCQCUNRRANAF-UHFFFAOYSA-N
XLogP0.51
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.51
H-Bond Donors ≤ 53
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 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CID 1268066) is 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is CC1(C)CC2(CC(C)(C)N1)NC(=O)NC2=O.
What is the InChIKey of 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is PNJCQCUNRRANAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-9(2)5-11(6-10(3,4)14-9)7(15)12-8(16)13-11/h14H,5-6H2,1-4H3,(H2,12,13,15,16).
What are the key properties of 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 225.29 g/mol, XLogP of 0.51, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,9,9-tetramethyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 1268066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).