8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine

C11H22F3NO — CID 105174487

IUPAC8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine
SMILESCNC(CCCC(F)(F)F)CC(C)COC
InChIInChI=1S/C11H22F3NO/c1-9(8-16-3)7-10(15-2)5-4-6-11(12,13)14/h9-10,15H,4-8H2,1-3H3
InChIKeyYYAJCJHDUIGNER-UHFFFAOYSA-N
MW241.30 g/mol
LogP2.98
Rot. Bonds8

About 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine

8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine (PubChem CID 105174487) has the molecular formula C11H22F3NO and a molecular weight of 241.30 g/mol. Its IUPAC name is 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine.

Molecular Properties

Compound Name8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine
PubChem CID105174487
Molecular FormulaC11H22F3NO
Molecular Weight241.30 g/mol
Exact Mass241.17
IUPAC Name8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine
SMILESCNC(CCCC(F)(F)F)CC(C)COC
InChIInChI=1S/C11H22F3NO/c1-9(8-16-3)7-10(15-2)5-4-6-11(12,13)14/h9-10,15H,4-8H2,1-3H3
InChIKeyYYAJCJHDUIGNER-UHFFFAOYSA-N
XLogP2.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-N,2,7-trimethyloctan-4-amine
CID 105127267
1-methoxy-N,2,7-trimethyloct-7-en-4-amine
CID 105182739
1-methoxy-N,2,6-trimethylnonan-4-amine
CID 105138093
1-methoxy-N,2,6-trimethyloctan-4-amine
CID 105138500
6,6,6-trifluoro-N,2-dimethylhexan-1-amine
CID 116536282
1-methoxy-N,6-dimethylheptan-4-amine
CID 62601315
7-methoxy-N,6-dimethylhept-1-en-4-amine
CID 105108659
8,8,8-trifluoro-1-methoxy-2-methyloctan-4-one
CID 105123384
1-methoxy-N,7-dimethyloctan-2-amine
CID 83158137
6,6,6-trifluoro-1-(4-methoxyphenyl)-N-methylhexan-2-amine
CID 115516486
1-methoxy-3-(6,6,6-trifluorohexan-2-ylamino)propan-2-ol
CID 116534815
(8,8,8-trifluoro-2-methyloctan-4-yl)hydrazine
CID 105198922

Frequently Asked Questions

What is the IUPAC name of 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine?
The IUPAC name of 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine (CID 105174487) is 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine.
What is the SMILES notation for 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine?
The canonical SMILES for 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine is CNC(CCCC(F)(F)F)CC(C)COC.
What is the InChIKey of 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine?
The InChIKey is YYAJCJHDUIGNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F3NO/c1-9(8-16-3)7-10(15-2)5-4-6-11(12,13)14/h9-10,15H,4-8H2,1-3H3.
What are the key properties of 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine?
8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine has a molecular weight of 241.30 g/mol, XLogP of 2.98, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8,8-trifluoro-1-methoxy-N,2-dimethyloctan-4-amine is sourced from PubChem (CID 105174487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).