(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine

C18H31N — CID 129066211

IUPAC(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine
SMILESCCCCC(/C=C(C)/C=C(C)\C=C(/C)C(C)C)=N\C
InChIInChI=1S/C18H31N/c1-8-9-10-18(19-7)13-16(5)11-15(4)12-17(6)14(2)3/h11-14H,8-10H2,1-7H3/b15-11-,16-13+,17-12+,19-18+
InChIKeyARCFFYDAUNJUFB-JERSEETPSA-N
MW261.45 g/mol
LogP5.74
Rot. Bonds7

About (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine

(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine (PubChem CID 129066211) has the molecular formula C18H31N and a molecular weight of 261.45 g/mol. Its IUPAC name is (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine.

Molecular Properties

Compound Name(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine
PubChem CID129066211
Molecular FormulaC18H31N
Molecular Weight261.45 g/mol
Exact Mass261.25
IUPAC Name(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine
SMILESCCCCC(/C=C(C)/C=C(C)\C=C(/C)C(C)C)=N\C
InChIInChI=1S/C18H31N/c1-8-9-10-18(19-7)13-16(5)11-15(4)12-17(6)14(2)3/h11-14H,8-10H2,1-7H3/b15-11-,16-13+,17-12+,19-18+
InChIKeyARCFFYDAUNJUFB-JERSEETPSA-N
XLogP5.74
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500261.45
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine?
The IUPAC name of (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine (CID 129066211) is (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine.
What is the SMILES notation for (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine?
The canonical SMILES for (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine is CCCCC(/C=C(C)/C=C(C)\C=C(/C)C(C)C)=N\C.
What is the InChIKey of (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine?
The InChIKey is ARCFFYDAUNJUFB-JERSEETPSA-N. The full InChI is InChI=1S/C18H31N/c1-8-9-10-18(19-7)13-16(5)11-15(4)12-17(6)14(2)3/h11-14H,8-10H2,1-7H3/b15-11-,16-13+,17-12+,19-18+.
What are the key properties of (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine?
(6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine has a molecular weight of 261.45 g/mol, XLogP of 5.74, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,8Z,10E)-N,7,9,11,12-pentamethyltrideca-6,8,10-trien-5-imine is sourced from PubChem (CID 129066211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).