1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine

C13H26N2 — CID 166890903

IUPAC1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine
SMILESC=C(CC)C(C)CC(CC)N1CCNC1
InChIInChI=1S/C13H26N2/c1-5-11(3)12(4)9-13(6-2)15-8-7-14-10-15/h12-14H,3,5-10H2,1-2,4H3
InChIKeyDEXINVXYJIVBSN-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.62
Rot. Bonds6

About 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine

1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine (PubChem CID 166890903) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine.

Molecular Properties

Compound Name1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine
PubChem CID166890903
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine
SMILESC=C(CC)C(C)CC(CC)N1CCNC1
InChIInChI=1S/C13H26N2/c1-5-11(3)12(4)9-13(6-2)15-8-7-14-10-15/h12-14H,3,5-10H2,1-2,4H3
InChIKeyDEXINVXYJIVBSN-UHFFFAOYSA-N
XLogP2.62
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine?
The IUPAC name of 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine (CID 166890903) is 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine.
What is the SMILES notation for 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine?
The canonical SMILES for 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine is C=C(CC)C(C)CC(CC)N1CCNC1.
What is the InChIKey of 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine?
The InChIKey is DEXINVXYJIVBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-5-11(3)12(4)9-13(6-2)15-8-7-14-10-15/h12-14H,3,5-10H2,1-2,4H3.
What are the key properties of 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine?
1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine has a molecular weight of 210.36 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-6-methylideneoctan-3-yl)imidazolidine is sourced from PubChem (CID 166890903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).