2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide

C11H17N3O3 — CID 139382770

IUPAC2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide
SMILESCCN1CCC2(CC1=O)CN(CC(N)=O)C2=O
InChIInChI=1S/C11H17N3O3/c1-2-13-4-3-11(5-9(13)16)7-14(10(11)17)6-8(12)15/h2-7H2,1H3,(H2,12,15)
InChIKeyLHVSJPMIHUYJJE-UHFFFAOYSA-N
MW239.27 g/mol
LogP-1.06
Rot. Bonds3

About 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide

2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide (PubChem CID 139382770) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide.

Molecular Properties

Compound Name2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide
PubChem CID139382770
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide
SMILESCCN1CCC2(CC1=O)CN(CC(N)=O)C2=O
InChIInChI=1S/C11H17N3O3/c1-2-13-4-3-11(5-9(13)16)7-14(10(11)17)6-8(12)15/h2-7H2,1H3,(H2,12,15)
InChIKeyLHVSJPMIHUYJJE-UHFFFAOYSA-N
XLogP-1.06
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-1.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide?
The IUPAC name of 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide (CID 139382770) is 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide.
What is the SMILES notation for 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide?
The canonical SMILES for 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide is CCN1CCC2(CC1=O)CN(CC(N)=O)C2=O.
What is the InChIKey of 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide?
The InChIKey is LHVSJPMIHUYJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-2-13-4-3-11(5-9(13)16)7-14(10(11)17)6-8(12)15/h2-7H2,1H3,(H2,12,15).
What are the key properties of 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide?
2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide has a molecular weight of 239.27 g/mol, XLogP of -1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-ethyl-3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)acetamide is sourced from PubChem (CID 139382770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).