1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione

C9H14N2O2 — CID 13423

IUPAC1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCN1C(=O)NC(=O)C12CCCCC2
InChIInChI=1S/C9H14N2O2/c1-11-8(13)10-7(12)9(11)5-3-2-4-6-9/h2-6H2,1H3,(H,10,12,13)
InChIKeyBVGOFWCNHZHTHW-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.87
Rot. Bonds

About 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione

1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 13423) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID13423
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCN1C(=O)NC(=O)C12CCCCC2
InChIInChI=1S/C9H14N2O2/c1-11-8(13)10-7(12)9(11)5-3-2-4-6-9/h2-6H2,1H3,(H,10,12,13)
InChIKeyBVGOFWCNHZHTHW-UHFFFAOYSA-N
XLogP0.87
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-Diazaspiro[4.5]decane-2,4-dione
CID 12799
8-Methyl-1,3-diazaspiro(4.5)decane-2,4-dione
CID 12817
1,3-Diazaspiro(4.5)decane-2,4-dione, 3-methyl-
CID 12816
CID 451207
CID 451207
3-(Chloromethyl)-2-hydroxy-1,3-diazaspiro(4.5)dec-1-en-4-one
CID 120427
6-Methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 227660
3-[2-(3,5-Dimethylpiperidin-1-yl)-2-oxoethyl]-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 4410214
1,3-Diazaspiro(4.5)decane-2,4-dione, 3-(hydroxymethyl)-
CID 12830
1,8-Dimethyl-1,3-diazaspiro[4.5]decane-2,4-dione
CID 3865268
5,5-Pentamethylene-3-vinylhydantoin
CID 294581
5-Cyclohexyl-5-methylimidazolidine-2,4-dione
CID 22785
1-Methyl-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 43840157

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione (CID 13423) is 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione is CN1C(=O)NC(=O)C12CCCCC2.
What is the InChIKey of 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is BVGOFWCNHZHTHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-11-8(13)10-7(12)9(11)5-3-2-4-6-9/h2-6H2,1H3,(H,10,12,13).
What are the key properties of 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione?
1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 182.22 g/mol, XLogP of 0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 13423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).