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

C15H26N2O2 — CID 64957234

IUPAC3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCCC(C)N1C(=O)C2(CCCCC2)NC(=O)C1C
InChIInChI=1S/C15H26N2O2/c1-4-8-11(2)17-12(3)13(18)16-15(14(17)19)9-6-5-7-10-15/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyOMSXYEGNHPBLFH-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.22
Rot. Bonds3

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

3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64957234) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64957234
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCCC(C)N1C(=O)C2(CCCCC2)NC(=O)C1C
InChIInChI=1S/C15H26N2O2/c1-4-8-11(2)17-12(3)13(18)16-15(14(17)19)9-6-5-7-10-15/h11-12H,4-10H2,1-3H3,(H,16,18)
InChIKeyOMSXYEGNHPBLFH-UHFFFAOYSA-N
XLogP2.22
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-methyl-9-pentan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64957246
9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64957601
3-methyl-4-(3-methylpentan-2-yl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64964453
4-(1-cyclopentylethyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64972302
8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681
8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887057
3-methyl-4-(2,3,3-trimethylbutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 83145037
9-(2-ethylhexyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64885340
8-methyl-9-octyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886104
4-(2,2-dimethylbutyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 103465383
3,3-diethyl-6-methyl-1-octan-2-ylpiperazine-2,5-dione
CID 64965106
3-methyl-4-(1-methylcyclohexyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64968199

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64957234) is 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione is CCCC(C)N1C(=O)C2(CCCCC2)NC(=O)C1C.
What is the InChIKey of 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is OMSXYEGNHPBLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-4-8-11(2)17-12(3)13(18)16-15(14(17)19)9-6-5-7-10-15/h11-12H,4-10H2,1-3H3,(H,16,18).
What are the key properties of 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione?
3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-pentan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64957234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).