(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine

C14H25N — CID 129175719

IUPAC(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine
SMILESC/C=C(\C)CC/C=C(\C)CC/C(C)=N/C
InChIInChI=1S/C14H25N/c1-6-12(2)8-7-9-13(3)10-11-14(4)15-5/h6,9H,7-8,10-11H2,1-5H3/b12-6+,13-9+,15-14+
InChIKeyFVVHEFIXSNPQEU-MNASQAFTSA-N
MW207.36 g/mol
LogP4.55
Rot. Bonds6

About (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine

(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine (PubChem CID 129175719) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine.

Molecular Properties

Compound Name(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine
PubChem CID129175719
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine
SMILESC/C=C(\C)CC/C=C(\C)CC/C(C)=N/C
InChIInChI=1S/C14H25N/c1-6-12(2)8-7-9-13(3)10-11-14(4)15-5/h6,9H,7-8,10-11H2,1-5H3/b12-6+,13-9+,15-14+
InChIKeyFVVHEFIXSNPQEU-MNASQAFTSA-N
XLogP4.55
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 54049885
ethane;(2E,6E,10E)-3,6,10-trimethyltrideca-2,6,10-triene
CID 145317511
ethane;(6E,10Z)-2,6,10-trimethyldodeca-2,6,10-triene
CID 143275958
(6E)-2,6-dimethylocta-2,6-diene
CID 5365898
(2E,6E)-1-chloro-2,6-dimethylocta-2,6-diene
CID 13409854
3,7,11-trimethylhexadeca-2,6,10-triene
CID 54031242
(1E,5E)-9-ethylimino-2,6-dimethyldeca-1,5-dien-1-amine
CID 145317446
(2Z,6E,10E,14E,18E,22Z)-6,10,15,19-tetramethyltetracosa-2,6,10,14,18,22-hexaene
CID 102073218
(5E,9E)-N-tert-butyl-5,9,12-trimethyltrideca-5,9-dien-2-imine
CID 138650644
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415

Frequently Asked Questions

What is the IUPAC name of (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine?
The IUPAC name of (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine (CID 129175719) is (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine.
What is the SMILES notation for (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine?
The canonical SMILES for (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine is C/C=C(\C)CC/C=C(\C)CC/C(C)=N/C.
What is the InChIKey of (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine?
The InChIKey is FVVHEFIXSNPQEU-MNASQAFTSA-N. The full InChI is InChI=1S/C14H25N/c1-6-12(2)8-7-9-13(3)10-11-14(4)15-5/h6,9H,7-8,10-11H2,1-5H3/b12-6+,13-9+,15-14+.
What are the key properties of (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine?
(5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine has a molecular weight of 207.36 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,9E)-N,5,9-trimethylundeca-5,9-dien-2-imine is sourced from PubChem (CID 129175719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).