(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine

C17H30FN — CID 134365586

IUPAC(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine
SMILESC=C/C(=C\C=C(/C)F)C(CC)CCCCN(C)CC
InChIInChI=1S/C17H30FN/c1-6-16(11-9-10-14-19(5)8-3)17(7-2)13-12-15(4)18/h7,12-13,16H,2,6,8-11,14H2,1,3-5H3/b15-12+,17-13+
InChIKeyUHKTVUZBLGAZKT-KDOCSACZSA-N
MW267.43 g/mol
LogP5.12
Rot. Bonds10

About (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine

(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine (PubChem CID 134365586) has the molecular formula C17H30FN and a molecular weight of 267.43 g/mol. Its IUPAC name is (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine.

Molecular Properties

Compound Name(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine
PubChem CID134365586
Molecular FormulaC17H30FN
Molecular Weight267.43 g/mol
Exact Mass267.24
IUPAC Name(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine
SMILESC=C/C(=C\C=C(/C)F)C(CC)CCCCN(C)CC
InChIInChI=1S/C17H30FN/c1-6-16(11-9-10-14-19(5)8-3)17(7-2)13-12-15(4)18/h7,12-13,16H,2,6,8-11,14H2,1,3-5H3/b15-12+,17-13+
InChIKeyUHKTVUZBLGAZKT-KDOCSACZSA-N
XLogP5.12
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.43
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 14525584
3,7-dimethyl-N,N-dipropyloct-6-en-1-amine
CID 13945554
N-(3-ethylheptyl)-1,5-difluoro-N-(2-methylpentyl)cyclohexa-2,4-dien-1-amine
CID 17948343
1-fluoro-N-(2-methylpentyl)-N-nonylcyclohexa-2,4-dien-1-amine
CID 23123042
N-(3-ethylheptyl)-1-fluoro-N-methylcyclohexa-2,4-dien-1-amine
CID 23123206
3-(4-fluorocyclohexa-2,4-dien-1-yl)-N,N-dimethylpropan-1-amine
CID 53831859
2-ethyl-6-fluoro-3,4,8,8a-tetrahydro-1H-isoquinoline
CID 89514110
N-[[(1R)-2-fluorocyclohex-3-en-1-yl]methyl]-N-methyl-2-[(4S)-4-methylcyclohex-2-en-1-yl]ethanamine
CID 118312653
4-(4-Fluorocyclohexa-1,3-dien-1-yl)-1-methylpiperidine
CID 118422995
1-(8-Fluoro-4,5-dimethylnona-5,7-dienyl)piperidine
CID 123361404
4-[1-(4-Fluoro-1-methylcyclohexa-2,4-dien-1-yl)ethenyl]-1-methylpiperidine
CID 129131717
4-fluoro-1-[(Z,2E)-3-methyl-2-propylidenehex-3-enyl]-4-prop-2-enylazepane
CID 130216894

Frequently Asked Questions

What is the IUPAC name of (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine?
The IUPAC name of (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine (CID 134365586) is (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine.
What is the SMILES notation for (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine?
The canonical SMILES for (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine is C=C/C(=C\C=C(/C)F)C(CC)CCCCN(C)CC.
What is the InChIKey of (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine?
The InChIKey is UHKTVUZBLGAZKT-KDOCSACZSA-N. The full InChI is InChI=1S/C17H30FN/c1-6-16(11-9-10-14-19(5)8-3)17(7-2)13-12-15(4)18/h7,12-13,16H,2,6,8-11,14H2,1,3-5H3/b15-12+,17-13+.
What are the key properties of (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine?
(6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine has a molecular weight of 267.43 g/mol, XLogP of 5.12, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,8E)-6-ethenyl-N,5-diethyl-9-fluoro-N-methyldeca-6,8-dien-1-amine is sourced from PubChem (CID 134365586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).