3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine

C11H20N2 — CID 123403764

IUPAC3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine
SMILESCCC1CC2(CC=CC2)CN1NC
InChIInChI=1S/C11H20N2/c1-3-10-8-11(6-4-5-7-11)9-13(10)12-2/h4-5,10,12H,3,6-9H2,1-2H3
InChIKeyULACWBRIRWYGKW-UHFFFAOYSA-N
MW180.30 g/mol
LogP1.94
Rot. Bonds2

About 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine

3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine (PubChem CID 123403764) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine.

Molecular Properties

Compound Name3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine
PubChem CID123403764
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC Name3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine
SMILESCCC1CC2(CC=CC2)CN1NC
InChIInChI=1S/C11H20N2/c1-3-10-8-11(6-4-5-7-11)9-13(10)12-2/h4-5,10,12H,3,6-9H2,1-2H3
InChIKeyULACWBRIRWYGKW-UHFFFAOYSA-N
XLogP1.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-2-methyl-1-[(Z)-3-methyloct-6-en-2-yl]hydrazine
CID 135199778
1-[(2Z)-7,7-dimethylcyclonon-2-en-1-yl]-1,2-dimethylhydrazine
CID 146259463
1-[1-(1,4-Dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine
CID 156743347

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine?
The IUPAC name of 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine (CID 123403764) is 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine.
What is the SMILES notation for 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine?
The canonical SMILES for 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine is CCC1CC2(CC=CC2)CN1NC.
What is the InChIKey of 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine?
The InChIKey is ULACWBRIRWYGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-3-10-8-11(6-4-5-7-11)9-13(10)12-2/h4-5,10,12H,3,6-9H2,1-2H3.
What are the key properties of 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine?
3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine has a molecular weight of 180.30 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine is sourced from PubChem (CID 123403764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).