10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione

C16H27NO2 — CID 79318355

IUPAC10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione
SMILESCC(C)CC1C(=O)NC(=O)CC12CCCC(C)(C)C2
InChIInChI=1S/C16H27NO2/c1-11(2)8-12-14(19)17-13(18)9-16(12)7-5-6-15(3,4)10-16/h11-12H,5-10H2,1-4H3,(H,17,18,19)
InChIKeyDVLOUIYBUPJCIO-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.28
Rot. Bonds2

About 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione

10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione (PubChem CID 79318355) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione.

Molecular Properties

Compound Name10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione
PubChem CID79318355
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione
SMILESCC(C)CC1C(=O)NC(=O)CC12CCCC(C)(C)C2
InChIInChI=1S/C16H27NO2/c1-11(2)8-12-14(19)17-13(18)9-16(12)7-5-6-15(3,4)10-16/h11-12H,5-10H2,1-4H3,(H,17,18,19)
InChIKeyDVLOUIYBUPJCIO-UHFFFAOYSA-N
XLogP3.28
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione with MolForge

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Related Compounds

10-ethyl-5-(2-methylpropyl)-3,10-diazaspiro[5.6]dodecane-2,4-dione
CID 79317646
5-(2-methylpropyl)-6-azaspiro[3.4]octan-7-one
CID 81251872
4-(methoxymethyl)-4-methyl-3-(2-methylpropyl)piperidine-2,6-dione
CID 79317410
4-[(4-fluorophenyl)methyl]-4-methyl-3-(2-methylpropyl)piperidine-2,6-dione
CID 114835105
9-benzyl-7-azaspiro[3.5]nonane-6,8-dione
CID 79317706
1-(2-methylpropyl)-2-azaspiro[4.4]nonan-3-one
CID 66108752
10-propan-2-yl-5-propyl-3-azaspiro[5.5]undecane-2,4-dione
CID 107450691
3-benzyl-4-methyl-4-(2-methylpropyl)piperidine-2,6-dione
CID 79317625
11-ethyl-2,2-dioxo-2λ6-thia-9-azaspiro[5.5]undecane-8,10-dione
CID 79320480
1-(2-methylpropyl)-9-oxa-2-azaspiro[4.5]decan-3-one
CID 66108745
5,9-di(propan-2-yl)-3-azaspiro[5.6]dodecane-2,4-dione
CID 79320757
1-(2-methylpropyl)-9,9-dioxo-9λ6-thia-2-azaspiro[4.5]decan-3-one
CID 66108308

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione?
The IUPAC name of 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione (CID 79318355) is 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione.
What is the SMILES notation for 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione?
The canonical SMILES for 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione is CC(C)CC1C(=O)NC(=O)CC12CCCC(C)(C)C2.
What is the InChIKey of 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione?
The InChIKey is DVLOUIYBUPJCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-11(2)8-12-14(19)17-13(18)9-16(12)7-5-6-15(3,4)10-16/h11-12H,5-10H2,1-4H3,(H,17,18,19).
What are the key properties of 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione?
10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione has a molecular weight of 265.40 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-5-(2-methylpropyl)-3-azaspiro[5.5]undecane-2,4-dione is sourced from PubChem (CID 79318355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).