3,6,8-trimethyldec-5-en-1-imine

C13H25N — CID 123837565

IUPAC3,6,8-trimethyldec-5-en-1-imine
SMILES[H]/N=C/CC(C)CC=C(C)CC(C)CC
InChIInChI=1S/C13H25N/c1-5-11(2)10-13(4)7-6-12(3)8-9-14/h7,9,11-12,14H,5-6,8,10H2,1-4H3/b13-7?,14-9+
InChIKeyVNVZRPZNQUVBQO-AEHRDBGISA-N
MW195.35 g/mol
LogP4.43
Rot. Bonds7

About 3,6,8-trimethyldec-5-en-1-imine

3,6,8-trimethyldec-5-en-1-imine (PubChem CID 123837565) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 3,6,8-trimethyldec-5-en-1-imine.

Molecular Properties

Compound Name3,6,8-trimethyldec-5-en-1-imine
PubChem CID123837565
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name3,6,8-trimethyldec-5-en-1-imine
SMILES[H]/N=C/CC(C)CC=C(C)CC(C)CC
InChIInChI=1S/C13H25N/c1-5-11(2)10-13(4)7-6-12(3)8-9-14/h7,9,11-12,14H,5-6,8,10H2,1-4H3/b13-7?,14-9+
InChIKeyVNVZRPZNQUVBQO-AEHRDBGISA-N
XLogP4.43
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 54.43
H-Bond Donors ≤ 51
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 89723
3,7-Dimethyloct-6-enal oxime
CID 5382814
1-[(E)-(2-isopropyl-5-methyl-hex-4-enylidene)amino]guanidine
CID 9573054
(E)-6,6,6-trifluoro-5-methyl-2-propylhex-4-en-1-imine
CID 89708392
2-[2-(2-Methylprop-1-enyl)-3-(2,2,2-trifluoroethyl)cyclopropyl]ethanimine
CID 123526598
(E)-6,6-difluoro-5-methyl-2-prop-1-en-2-ylhept-4-en-1-imine
CID 126497184
Citronellal oxime
CID 6299203
Citronellalaldoxim
CID 71608065
(6S)-8-diazo-2,6-dimethyloct-2-ene
CID 72722697
(2Z)-2-ethylidene-4-methyl-3-(trifluoromethyl)hexan-1-imine
CID 152802956
2-[(Z)-3,7-dimethyloct-6-enylideneamino]guanidine;hydrochloride
CID 54605666
N-tert-butyl-3,7-dimethyloct-6-en-1-imine
CID 20591843

Frequently Asked Questions

What is the IUPAC name of 3,6,8-trimethyldec-5-en-1-imine?
The IUPAC name of 3,6,8-trimethyldec-5-en-1-imine (CID 123837565) is 3,6,8-trimethyldec-5-en-1-imine.
What is the SMILES notation for 3,6,8-trimethyldec-5-en-1-imine?
The canonical SMILES for 3,6,8-trimethyldec-5-en-1-imine is [H]/N=C/CC(C)CC=C(C)CC(C)CC.
What is the InChIKey of 3,6,8-trimethyldec-5-en-1-imine?
The InChIKey is VNVZRPZNQUVBQO-AEHRDBGISA-N. The full InChI is InChI=1S/C13H25N/c1-5-11(2)10-13(4)7-6-12(3)8-9-14/h7,9,11-12,14H,5-6,8,10H2,1-4H3/b13-7?,14-9+.
What are the key properties of 3,6,8-trimethyldec-5-en-1-imine?
3,6,8-trimethyldec-5-en-1-imine has a molecular weight of 195.35 g/mol, XLogP of 4.43, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,8-trimethyldec-5-en-1-imine is sourced from PubChem (CID 123837565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).