5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine

C8H14FN — CID 123986678

IUPAC5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine
SMILESCC(F)=CC=C(C)N(C)C
InChIInChI=1S/C8H14FN/c1-7(9)5-6-8(2)10(3)4/h5-6H,1-4H3
InChIKeyJEOLGAQUDMMUCA-UHFFFAOYSA-N
MW143.20 g/mol
LogP2.33
Rot. Bonds2

About 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine

5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine (PubChem CID 123986678) has the molecular formula C8H14FN and a molecular weight of 143.20 g/mol. Its IUPAC name is 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine.

Molecular Properties

Compound Name5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine
PubChem CID123986678
Molecular FormulaC8H14FN
Molecular Weight143.20 g/mol
Exact Mass143.11
IUPAC Name5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine
SMILESCC(F)=CC=C(C)N(C)C
InChIInChI=1S/C8H14FN/c1-7(9)5-6-8(2)10(3)4/h5-6H,1-4H3
InChIKeyJEOLGAQUDMMUCA-UHFFFAOYSA-N
XLogP2.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.20
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,2,7-Trimethylazepine
CID 21766428
(2Z)-3-fluoro-1-methyl-2-prop-2-enylidenepyridine
CID 88227504
3-fluoro-N,N-dimethylhexa-1,3,5-trien-2-amine
CID 123814892
N-methyl-N-(3,3,3-trifluoroprop-1-en-2-yl)penta-2,4-dien-2-amine
CID 123892342
(2Z)-1,1,1-trifluoro-N,N-dimethylpenta-2,4-dien-2-amine
CID 139385369
2-Fluoro-1-methyl-6-methylidenepyridine
CID 142198451
3-fluoro-1,6-dimethyl-2H-pyridine
CID 145003766
(3E)-5-fluoro-N,N-dimethylhexa-1,3,5-trien-3-amine
CID 145466323
(E)-1-fluoro-N-methyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 146392901
(2Z,4Z)-N-ethyl-3-fluoro-N-methylhepta-2,4,6-trien-2-amine
CID 146595709
(2Z,4Z)-3-fluoro-N,N-dimethylhepta-2,4,6-trien-2-amine
CID 155197849
(3Z,5E)-6-fluoro-N,N-dimethylhepta-1,3,5-trien-2-amine
CID 156542875

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine?
The IUPAC name of 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine (CID 123986678) is 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine.
What is the SMILES notation for 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine?
The canonical SMILES for 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine is CC(F)=CC=C(C)N(C)C.
What is the InChIKey of 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine?
The InChIKey is JEOLGAQUDMMUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FN/c1-7(9)5-6-8(2)10(3)4/h5-6H,1-4H3.
What are the key properties of 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine?
5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine has a molecular weight of 143.20 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N,N-dimethylhexa-2,4-dien-2-amine is sourced from PubChem (CID 123986678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).