6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine

C15H30F3N — CID 79964664

IUPAC6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine
SMILESCCCCC(CC)CC(CCC(F)(F)F)NCCC
InChIInChI=1S/C15H30F3N/c1-4-7-8-13(6-3)12-14(19-11-5-2)9-10-15(16,17)18/h13-14,19H,4-12H2,1-3H3
InChIKeyVEFOWZFUYOGMPL-UHFFFAOYSA-N
MW281.41 g/mol
LogP5.30
Rot. Bonds11

About 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine

6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine (PubChem CID 79964664) has the molecular formula C15H30F3N and a molecular weight of 281.41 g/mol. Its IUPAC name is 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine.

Molecular Properties

Compound Name6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine
PubChem CID79964664
Molecular FormulaC15H30F3N
Molecular Weight281.41 g/mol
Exact Mass281.23
IUPAC Name6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine
SMILESCCCCC(CC)CC(CCC(F)(F)F)NCCC
InChIInChI=1S/C15H30F3N/c1-4-7-8-13(6-3)12-14(19-11-5-2)9-10-15(16,17)18/h13-14,19H,4-12H2,1-3H3
InChIKeyVEFOWZFUYOGMPL-UHFFFAOYSA-N
XLogP5.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.41
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-ethyl-1-N,1-N-dimethyl-3-N-propylnonane-1,3-diamine
CID 113291360
1,1,1-trifluoro-N-propyldodecan-4-amine
CID 79964145
8,8,8-trifluoro-2-methyl-N-propyloctan-4-amine
CID 115516392
4-ethyl-1-(2-methylpropylsulfanyl)-N-propyloctan-2-amine
CID 65135765
2-ethyl-N-(4,4,4-trifluorobutyl)hexan-1-amine
CID 115518505
N-ethyl-1,1,1-trifluorooctan-4-amine
CID 79404596
N,5-diethylpentadecan-7-amine
CID 115806799
1-ethylsulfanyl-5,5,5-trifluoro-N-propylpentan-2-amine
CID 65128350
1-butan-2-ylsulfanyl-6,6,6-trifluoro-N-propylhexan-2-amine
CID 115516904
1,1,1-trifluoro-N-propyloct-6-yn-4-amine
CID 79964063
4-ethyl-2-(ethylamino)octan-1-ol
CID 174812518
N-propyl-1-(2,2,2-trifluoroethoxy)hexan-2-amine
CID 103214890

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine?
The IUPAC name of 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine (CID 79964664) is 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine.
What is the SMILES notation for 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine?
The canonical SMILES for 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine is CCCCC(CC)CC(CCC(F)(F)F)NCCC.
What is the InChIKey of 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine?
The InChIKey is VEFOWZFUYOGMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30F3N/c1-4-7-8-13(6-3)12-14(19-11-5-2)9-10-15(16,17)18/h13-14,19H,4-12H2,1-3H3.
What are the key properties of 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine?
6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine has a molecular weight of 281.41 g/mol, XLogP of 5.30, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1,1,1-trifluoro-N-propyldecan-4-amine is sourced from PubChem (CID 79964664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).