8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine

C12H23N3O — CID 79504790

IUPAC8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCCC1CCC2(CN=C(N)N2CCOC)C1
InChIInChI=1S/C12H23N3O/c1-3-10-4-5-12(8-10)9-14-11(13)15(12)6-7-16-2/h10H,3-9H2,1-2H3,(H2,13,14)
InChIKeyLYAFTIIYXDJCCZ-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.21
Rot. Bonds4

About 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine

8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine (PubChem CID 79504790) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine.

Molecular Properties

Compound Name8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine
PubChem CID79504790
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine
SMILESCCC1CCC2(CN=C(N)N2CCOC)C1
InChIInChI=1S/C12H23N3O/c1-3-10-4-5-12(8-10)9-14-11(13)15(12)6-7-16-2/h10H,3-9H2,1-2H3,(H2,13,14)
InChIKeyLYAFTIIYXDJCCZ-UHFFFAOYSA-N
XLogP1.21
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine?
The IUPAC name of 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine (CID 79504790) is 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine.
What is the SMILES notation for 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine?
The canonical SMILES for 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine is CCC1CCC2(CN=C(N)N2CCOC)C1.
What is the InChIKey of 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine?
The InChIKey is LYAFTIIYXDJCCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-3-10-4-5-12(8-10)9-14-11(13)15(12)6-7-16-2/h10H,3-9H2,1-2H3,(H2,13,14).
What are the key properties of 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine?
8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine has a molecular weight of 225.34 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-1-(2-methoxyethyl)-1,3-diazaspiro[4.4]non-2-en-2-amine is sourced from PubChem (CID 79504790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).