(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine

C13H24N2 — CID 134386167

IUPAC(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine
SMILESC=C/N=C(/C=C\C)CCCCN(C)CC
InChIInChI=1S/C13H24N2/c1-5-10-13(14-6-2)11-8-9-12-15(4)7-3/h5-6,10H,2,7-9,11-12H2,1,3-4H3/b10-5-,14-13-
InChIKeyXRNZSCQYYINKID-SLHHIHMXSA-N
MW208.35 g/mol
LogP3.27
Rot. Bonds8

About (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine

(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine (PubChem CID 134386167) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine.

Molecular Properties

Compound Name(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine
PubChem CID134386167
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine
SMILESC=C/N=C(/C=C\C)CCCCN(C)CC
InChIInChI=1S/C13H24N2/c1-5-10-13(14-6-2)11-8-9-12-15(4)7-3/h5-6,10H,2,7-9,11-12H2,1,3-4H3/b10-5-,14-13-
InChIKeyXRNZSCQYYINKID-SLHHIHMXSA-N
XLogP3.27
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine?
The IUPAC name of (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine (CID 134386167) is (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine.
What is the SMILES notation for (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine?
The canonical SMILES for (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine is C=C/N=C(/C=C\C)CCCCN(C)CC.
What is the InChIKey of (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine?
The InChIKey is XRNZSCQYYINKID-SLHHIHMXSA-N. The full InChI is InChI=1S/C13H24N2/c1-5-10-13(14-6-2)11-8-9-12-15(4)7-3/h5-6,10H,2,7-9,11-12H2,1,3-4H3/b10-5-,14-13-.
What are the key properties of (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine?
(Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine has a molecular weight of 208.35 g/mol, XLogP of 3.27, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-ethenylimino-N-ethyl-N-methyloct-6-en-1-amine is sourced from PubChem (CID 134386167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).