(E)-N,2,5-trimethyldec-4-en-3-imine

C13H25N — CID 166992287

IUPAC(E)-N,2,5-trimethyldec-4-en-3-imine
SMILESCCCCC/C(C)=C/C(=N/C)C(C)C
InChIInChI=1S/C13H25N/c1-6-7-8-9-12(4)10-13(14-5)11(2)3/h10-11H,6-9H2,1-5H3/b12-10+,14-13-
InChIKeyUNKQVJSYQGDODU-FJDRKQEFSA-N
MW195.35 g/mol
LogP4.24
Rot. Bonds6

About (E)-N,2,5-trimethyldec-4-en-3-imine

(E)-N,2,5-trimethyldec-4-en-3-imine (PubChem CID 166992287) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is (E)-N,2,5-trimethyldec-4-en-3-imine.

Molecular Properties

Compound Name(E)-N,2,5-trimethyldec-4-en-3-imine
PubChem CID166992287
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name(E)-N,2,5-trimethyldec-4-en-3-imine
SMILESCCCCC/C(C)=C/C(=N/C)C(C)C
InChIInChI=1S/C13H25N/c1-6-7-8-9-12(4)10-13(14-5)11(2)3/h10-11H,6-9H2,1-5H3/b12-10+,14-13-
InChIKeyUNKQVJSYQGDODU-FJDRKQEFSA-N
XLogP4.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N,2,5-trimethyl-4-methylimino-N-propylhex-2-en-1-amine
CID 166464768
4-methylundec-3-en-2-one
CID 103970939
(E)-4-methyldodec-3-en-2-one
CID 19609505
4-methyltetradec-3-en-2-ol
CID 71428210
(Z)-4-methylundec-3-en-2-one
CID 121464257
2,3,6-trimethylundec-5-ene
CID 123502967
(6E,8E)-6,9-dimethyltetradeca-6,8-diene
CID 16741365
(Z)-12-methylhenicos-11-en-10-one
CID 122379193
(2E,4E)-3,5-dimethylicosa-2,4-dienoic acid
CID 11056828
2-methylhept-1-en-1-ol
CID 141483452
3-methyldec-2-ene
CID 550799
(E)-3-methyltridec-2-ene
CID 22000795

Frequently Asked Questions

What is the IUPAC name of (E)-N,2,5-trimethyldec-4-en-3-imine?
The IUPAC name of (E)-N,2,5-trimethyldec-4-en-3-imine (CID 166992287) is (E)-N,2,5-trimethyldec-4-en-3-imine.
What is the SMILES notation for (E)-N,2,5-trimethyldec-4-en-3-imine?
The canonical SMILES for (E)-N,2,5-trimethyldec-4-en-3-imine is CCCCC/C(C)=C/C(=N/C)C(C)C.
What is the InChIKey of (E)-N,2,5-trimethyldec-4-en-3-imine?
The InChIKey is UNKQVJSYQGDODU-FJDRKQEFSA-N. The full InChI is InChI=1S/C13H25N/c1-6-7-8-9-12(4)10-13(14-5)11(2)3/h10-11H,6-9H2,1-5H3/b12-10+,14-13-.
What are the key properties of (E)-N,2,5-trimethyldec-4-en-3-imine?
(E)-N,2,5-trimethyldec-4-en-3-imine has a molecular weight of 195.35 g/mol, XLogP of 4.24, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,2,5-trimethyldec-4-en-3-imine is sourced from PubChem (CID 166992287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).