4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione

C13H22N2O2 — CID 64885908

IUPAC4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCCC1C(=O)NC2(CCCCC2)C(=O)N1C
InChIInChI=1S/C13H22N2O2/c1-3-7-10-11(16)14-13(12(17)15(10)2)8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,14,16)
InChIKeyQSJCZLKUUZWCHI-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.45
Rot. Bonds2

About 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione

4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64885908) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64885908
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCCC1C(=O)NC2(CCCCC2)C(=O)N1C
InChIInChI=1S/C13H22N2O2/c1-3-7-10-11(16)14-13(12(17)15(10)2)8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,14,16)
InChIKeyQSJCZLKUUZWCHI-UHFFFAOYSA-N
XLogP1.45
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-(2,2-difluoroethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886654
9-(2-ethoxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887608
4-butyl-3-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64886290
9-(4-methoxybutyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 104650420
8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887606
8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681
8-ethyl-9-(3,3,3-trifluoropropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64885889
8-ethyl-9-(1-methylcyclopentyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64973613
3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64958744
8-methyl-9-octyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886104
3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64957234
8-ethyl-9-(5-methylhexyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 115327199

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64885908) is 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione is CCCC1C(=O)NC2(CCCCC2)C(=O)N1C.
What is the InChIKey of 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is QSJCZLKUUZWCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-3-7-10-11(16)14-13(12(17)15(10)2)8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,14,16).
What are the key properties of 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 238.33 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64885908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).