7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine

C13H25N3O — CID 79504926

IUPAC7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCCC1CCCC2(CN=C(N)N2CCOC)C1
InChIInChI=1S/C13H25N3O/c1-3-11-5-4-6-13(9-11)10-15-12(14)16(13)7-8-17-2/h11H,3-10H2,1-2H3,(H2,14,15)
InChIKeyQPLCCCLCNNAGEV-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.60
Rot. Bonds4

About 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine

7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 79504926) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID79504926
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCCC1CCCC2(CN=C(N)N2CCOC)C1
InChIInChI=1S/C13H25N3O/c1-3-11-5-4-6-13(9-11)10-15-12(14)16(13)7-8-17-2/h11H,3-10H2,1-2H3,(H2,14,15)
InChIKeyQPLCCCLCNNAGEV-UHFFFAOYSA-N
XLogP1.60
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 79504926) is 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine is CCC1CCCC2(CN=C(N)N2CCOC)C1.
What is the InChIKey of 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is QPLCCCLCNNAGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-3-11-5-4-6-13(9-11)10-15-12(14)16(13)7-8-17-2/h11H,3-10H2,1-2H3,(H2,14,15).
What are the key properties of 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine?
7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 239.36 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 79504926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).