4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

C11H19N3O — CID 79960233

IUPAC4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCC(C)C1CCC2(CC1)NC(=O)N=C2N
InChIInChI=1S/C11H19N3O/c1-7(2)8-3-5-11(6-4-8)9(12)13-10(15)14-11/h7-8H,3-6H2,1-2H3,(H3,12,13,14,15)
InChIKeyLFPPVTYIBTWTFG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.65
Rot. Bonds1

About 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (PubChem CID 79960233) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
PubChem CID79960233
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCC(C)C1CCC2(CC1)NC(=O)N=C2N
InChIInChI=1S/C11H19N3O/c1-7(2)8-3-5-11(6-4-8)9(12)13-10(15)14-11/h7-8H,3-6H2,1-2H3,(H3,12,13,14,15)
InChIKeyLFPPVTYIBTWTFG-UHFFFAOYSA-N
XLogP1.65
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (CID 79960233) is 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is CC(C)C1CCC2(CC1)NC(=O)N=C2N.
What is the InChIKey of 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The InChIKey is LFPPVTYIBTWTFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7(2)8-3-5-11(6-4-8)9(12)13-10(15)14-11/h7-8H,3-6H2,1-2H3,(H3,12,13,14,15).
What are the key properties of 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one has a molecular weight of 209.29 g/mol, XLogP of 1.65, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 79960233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).