1-(4-ethylideneoct-2-en-2-yl)imidazolidine

C13H24N2 — CID 90694119

IUPAC1-(4-ethylideneoct-2-en-2-yl)imidazolidine
SMILESCC=C(C=C(C)N1CCNC1)CCCC
InChIInChI=1S/C13H24N2/c1-4-6-7-13(5-2)10-12(3)15-9-8-14-11-15/h5,10,14H,4,6-9,11H2,1-3H3
InChIKeyTUJKJONNTNEJPS-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.89
Rot. Bonds5

About 1-(4-ethylideneoct-2-en-2-yl)imidazolidine

1-(4-ethylideneoct-2-en-2-yl)imidazolidine (PubChem CID 90694119) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-(4-ethylideneoct-2-en-2-yl)imidazolidine.

Molecular Properties

Compound Name1-(4-ethylideneoct-2-en-2-yl)imidazolidine
PubChem CID90694119
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name1-(4-ethylideneoct-2-en-2-yl)imidazolidine
SMILESCC=C(C=C(C)N1CCNC1)CCCC
InChIInChI=1S/C13H24N2/c1-4-6-7-13(5-2)10-12(3)15-9-8-14-11-15/h5,10,14H,4,6-9,11H2,1-3H3
InChIKeyTUJKJONNTNEJPS-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylideneoct-2-en-2-yl)imidazolidine?
The IUPAC name of 1-(4-ethylideneoct-2-en-2-yl)imidazolidine (CID 90694119) is 1-(4-ethylideneoct-2-en-2-yl)imidazolidine.
What is the SMILES notation for 1-(4-ethylideneoct-2-en-2-yl)imidazolidine?
The canonical SMILES for 1-(4-ethylideneoct-2-en-2-yl)imidazolidine is CC=C(C=C(C)N1CCNC1)CCCC.
What is the InChIKey of 1-(4-ethylideneoct-2-en-2-yl)imidazolidine?
The InChIKey is TUJKJONNTNEJPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-6-7-13(5-2)10-12(3)15-9-8-14-11-15/h5,10,14H,4,6-9,11H2,1-3H3.
What are the key properties of 1-(4-ethylideneoct-2-en-2-yl)imidazolidine?
1-(4-ethylideneoct-2-en-2-yl)imidazolidine has a molecular weight of 208.35 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylideneoct-2-en-2-yl)imidazolidine is sourced from PubChem (CID 90694119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).