4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione

C15H26N2O2 — CID 64970002

IUPAC4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCC(C)CCCN1CC(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C15H26N2O2/c1-12(2)7-6-10-17-11-13(18)16-15(14(17)19)8-4-3-5-9-15/h12H,3-11H2,1-2H3,(H,16,18)
InChIKeyMIXWWXYJSXDEQC-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.08
Rot. Bonds4

About 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione

4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64970002) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64970002
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCC(C)CCCN1CC(=O)NC2(CCCCC2)C1=O
InChIInChI=1S/C15H26N2O2/c1-12(2)7-6-10-17-11-13(18)16-15(14(17)19)8-4-3-5-9-15/h12H,3-11H2,1-2H3,(H,16,18)
InChIKeyMIXWWXYJSXDEQC-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-(7-methyloctyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107818476
3,3-dimethyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 64970606
4-(4-methoxybutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64967479
4-(3-ethoxypropyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64958546
4-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64879190
3,3-diethyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 64969958
9-(3-ethoxypropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64959195
3-ethyl-3-methyl-1-(4-methylpentyl)piperazine-2,5-dione
CID 64970582
3,3-dimethyl-4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 83149403
4-(2-propylsulfonylethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 106733699
9-(2-butoxyethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64878863
9-(3,3,3-trifluoropropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64880199

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64970002) is 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is CC(C)CCCN1CC(=O)NC2(CCCCC2)C1=O.
What is the InChIKey of 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is MIXWWXYJSXDEQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-12(2)7-6-10-17-11-13(18)16-15(14(17)19)8-4-3-5-9-15/h12H,3-11H2,1-2H3,(H,16,18).
What are the key properties of 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione?
4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpentyl)-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64970002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).