5-fluoro-N,8-dimethylnon-5-en-2-amine

C11H22FN — CID 123595869

IUPAC5-fluoro-N,8-dimethylnon-5-en-2-amine
SMILESCNC(C)CCC(F)=CCC(C)C
InChIInChI=1S/C11H22FN/c1-9(2)5-7-11(12)8-6-10(3)13-4/h7,9-10,13H,5-6,8H2,1-4H3
InChIKeyXBNMUIGEXUDIKA-UHFFFAOYSA-N
MW187.30 g/mol
LogP3.27
Rot. Bonds6

About 5-fluoro-N,8-dimethylnon-5-en-2-amine

5-fluoro-N,8-dimethylnon-5-en-2-amine (PubChem CID 123595869) has the molecular formula C11H22FN and a molecular weight of 187.30 g/mol. Its IUPAC name is 5-fluoro-N,8-dimethylnon-5-en-2-amine.

Molecular Properties

Compound Name5-fluoro-N,8-dimethylnon-5-en-2-amine
PubChem CID123595869
Molecular FormulaC11H22FN
Molecular Weight187.30 g/mol
Exact Mass187.17
IUPAC Name5-fluoro-N,8-dimethylnon-5-en-2-amine
SMILESCNC(C)CCC(F)=CCC(C)C
InChIInChI=1S/C11H22FN/c1-9(2)5-7-11(12)8-6-10(3)13-4/h7,9-10,13H,5-6,8H2,1-4H3
InChIKeyXBNMUIGEXUDIKA-UHFFFAOYSA-N
XLogP3.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.30
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Isometheptene
CID 22297
Isometheptene Hydrochloride
CID 22549
Dexisometheptene
CID 24871315
Isometheptene-mucate
CID 6604597
4-Hexenylamine, N,1,2,5-tetramethyl-
CID 49627
4-Hexenylamine, N,1-dimethyl-
CID 6435019
(2,6-Dimethylhept-5-en-1-yl)(methyl)amine
CID 146817482
6-Methyl-2-propylamino-5-heptene
CID 12541942
Methyl(6-methylhept-5-en-2-yl)azanium chloride
CID 53447279
(E)-1,1,1-trifluoro-N,8-dimethylnon-5-en-2-amine
CID 88588160
(Z)-1,1,1-trifluoro-N,8-dimethylnon-5-en-2-amine
CID 88588161
(E)-N-(2,2-difluoroethyl)-7,7,7-trifluoro-6-methylhept-5-en-2-amine
CID 121451126

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N,8-dimethylnon-5-en-2-amine?
The IUPAC name of 5-fluoro-N,8-dimethylnon-5-en-2-amine (CID 123595869) is 5-fluoro-N,8-dimethylnon-5-en-2-amine.
What is the SMILES notation for 5-fluoro-N,8-dimethylnon-5-en-2-amine?
The canonical SMILES for 5-fluoro-N,8-dimethylnon-5-en-2-amine is CNC(C)CCC(F)=CCC(C)C.
What is the InChIKey of 5-fluoro-N,8-dimethylnon-5-en-2-amine?
The InChIKey is XBNMUIGEXUDIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FN/c1-9(2)5-7-11(12)8-6-10(3)13-4/h7,9-10,13H,5-6,8H2,1-4H3.
What are the key properties of 5-fluoro-N,8-dimethylnon-5-en-2-amine?
5-fluoro-N,8-dimethylnon-5-en-2-amine has a molecular weight of 187.30 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N,8-dimethylnon-5-en-2-amine is sourced from PubChem (CID 123595869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).