(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine

C20H39NO — CID 16729186

IUPAC(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine
SMILESCCCCCCOC/C=C(\C)CCC=C(C)CCCN(C)C
InChIInChI=1S/C20H39NO/c1-6-7-8-9-17-22-18-15-20(3)13-10-12-19(2)14-11-16-21(4)5/h12,15H,6-11,13-14,16-18H2,1-5H3/b19-12?,20-15+
InChIKeyDYKXYQSMPCJKBO-PZCKQXFPSA-N
MW309.54 g/mol
LogP5.60
Rot. Bonds14

About (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine

(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine (PubChem CID 16729186) has the molecular formula C20H39NO and a molecular weight of 309.54 g/mol. Its IUPAC name is (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine.

Molecular Properties

Compound Name(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine
PubChem CID16729186
Molecular FormulaC20H39NO
Molecular Weight309.54 g/mol
Exact Mass309.30
IUPAC Name(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine
SMILESCCCCCCOC/C=C(\C)CCC=C(C)CCCN(C)C
InChIInChI=1S/C20H39NO/c1-6-7-8-9-17-22-18-15-20(3)13-10-12-19(2)14-11-16-21(4)5/h12,15H,6-11,13-14,16-18H2,1-5H3/b19-12?,20-15+
InChIKeyDYKXYQSMPCJKBO-PZCKQXFPSA-N
XLogP5.60
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.54
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4E,8E)-10-(hexyloxy)-N,N,4,8-tetramethyldeca-4,8-dien-1-amine
CID 44440595
N,N-dibutyl-4-(2-methylprop-2-enyl)-2,5-dihydrofuran-2-amine
CID 154710504
N-[cyclohexen-1-yl(methoxy)methyl]-N-ethylethanamine
CID 123429243
3-[(2E,6Z)-2,6-dimethyldodeca-2,6-dienoxy]-N,N-dimethylpropan-1-amine
CID 139502223
(E)-N,N-diethyl-3-(methoxymethyl)hex-2-en-1-amine;ethane;propane
CID 144711890
N,N-dimethyl-3-[(E)-2-methyl-6-methylideneoct-2-enoxy]propan-1-amine
CID 146551805
4-(3,6-dihydro-2H-pyran-4-yl)-1-methyl-3,6-dihydro-2H-pyridine
CID 146561681
(3E)-2,8-diethyl-3-(methoxymethyl)-N,N-dimethyldeca-3,7-dien-1-amine
CID 155402658
lithium 3-[(2E,6Z)-6-methanidyl-2-methyldodeca-2,6-dienoxy]-N,N-dimethylpropan-1-amine
CID 155617683
lithium 3-[(2Z,6Z)-6-methanidyl-2-methyldodeca-2,6-dienoxy]-N,N-dimethylpropan-1-amine
CID 156682918
(4Z,7E,12Z)-N,N,7-trimethyl-9-(2-methylpropoxy)tetradeca-4,7,12-trien-1-amine
CID 169940450
CID 173887143
CID 173887143

Frequently Asked Questions

What is the IUPAC name of (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine?
The IUPAC name of (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine (CID 16729186) is (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine.
What is the SMILES notation for (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine?
The canonical SMILES for (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine is CCCCCCOC/C=C(\C)CCC=C(C)CCCN(C)C.
What is the InChIKey of (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine?
The InChIKey is DYKXYQSMPCJKBO-PZCKQXFPSA-N. The full InChI is InChI=1S/C20H39NO/c1-6-7-8-9-17-22-18-15-20(3)13-10-12-19(2)14-11-16-21(4)5/h12,15H,6-11,13-14,16-18H2,1-5H3/b19-12?,20-15+.
What are the key properties of (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine?
(8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine has a molecular weight of 309.54 g/mol, XLogP of 5.60, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8E)-10-hexoxy-N,N,4,8-tetramethyldeca-4,8-dien-1-amine is sourced from PubChem (CID 16729186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).