9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione

C17H28N2O2 — CID 107902251

IUPAC9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(C)=CCN1C(=O)C2(CCCC2)NC(=O)C1CC(C)C
InChIInChI=1S/C17H28N2O2/c1-12(2)7-10-19-14(11-13(3)4)15(20)18-17(16(19)21)8-5-6-9-17/h7,13-14H,5-6,8-11H2,1-4H3,(H,18,20)
InChIKeyNKNAJTQQMZFYIF-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.64
Rot. Bonds4

About 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione

9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 107902251) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID107902251
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(C)=CCN1C(=O)C2(CCCC2)NC(=O)C1CC(C)C
InChIInChI=1S/C17H28N2O2/c1-12(2)7-10-19-14(11-13(3)4)15(20)18-17(16(19)21)8-5-6-9-17/h7,13-14H,5-6,8-11H2,1-4H3,(H,18,20)
InChIKeyNKNAJTQQMZFYIF-UHFFFAOYSA-N
XLogP2.64
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione with MolForge

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Related Compounds

4-(3-methylbut-2-enyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107902269
8-(2-methylpropyl)-9-(2,2,2-trifluoroethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887040
8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887057
8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887606
8-ethyl-9-(2-methylprop-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114619330
8-ethyl-9-(5-methylhexyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 115327199
4-(3-chloro-2-methylprop-2-enyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 106440744
8,8-dimethyl-9-(3-methylbut-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107902275
9-(2,2-difluoroethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886654
8-methyl-9-(2-methylsulfanylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 113466968
8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681
3-methyl-4-(2,3,3-trimethylbutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 83145037

Frequently Asked Questions

What is the IUPAC name of 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione (CID 107902251) is 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione is CC(C)=CCN1C(=O)C2(CCCC2)NC(=O)C1CC(C)C.
What is the InChIKey of 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is NKNAJTQQMZFYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-12(2)7-10-19-14(11-13(3)4)15(20)18-17(16(19)21)8-5-6-9-17/h7,13-14H,5-6,8-11H2,1-4H3,(H,18,20).
What are the key properties of 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 292.42 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-methylbut-2-enyl)-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 107902251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).