9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C13H22N2O2 — CID 64957601

IUPAC9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC(C)N1C(=O)C2(CCCC2)NC(=O)C1C
InChIInChI=1S/C13H22N2O2/c1-4-9(2)15-10(3)11(16)14-13(12(15)17)7-5-6-8-13/h9-10H,4-8H2,1-3H3,(H,14,16)
InChIKeyIAKSIJBGLWQHCW-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.44
Rot. Bonds2

About 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64957601) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64957601
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC(C)N1C(=O)C2(CCCC2)NC(=O)C1C
InChIInChI=1S/C13H22N2O2/c1-4-9(2)15-10(3)11(16)14-13(12(15)17)7-5-6-8-13/h9-10H,4-8H2,1-3H3,(H,14,16)
InChIKeyIAKSIJBGLWQHCW-UHFFFAOYSA-N
XLogP1.44
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 ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64957601) is 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is CCC(C)N1C(=O)C2(CCCC2)NC(=O)C1C.
What is the InChIKey of 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is IAKSIJBGLWQHCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-9(2)15-10(3)11(16)14-13(12(15)17)7-5-6-8-13/h9-10H,4-8H2,1-3H3,(H,14,16).
What are the key properties of 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 238.33 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-butan-2-yl-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64957601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).