6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine

C14H30FNO — CID 103392578

IUPAC6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine
SMILESCCCCC(CC)CC(F)(CCCN)COC
InChIInChI=1S/C14H30FNO/c1-4-6-8-13(5-2)11-14(15,12-17-3)9-7-10-16/h13H,4-12,16H2,1-3H3
InChIKeyLEDYEZNVHPBLLI-UHFFFAOYSA-N
MW247.40 g/mol
LogP3.69
Rot. Bonds11

About 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine

6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine (PubChem CID 103392578) has the molecular formula C14H30FNO and a molecular weight of 247.40 g/mol. Its IUPAC name is 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine.

Molecular Properties

Compound Name6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine
PubChem CID103392578
Molecular FormulaC14H30FNO
Molecular Weight247.40 g/mol
Exact Mass247.23
IUPAC Name6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine
SMILESCCCCC(CC)CC(F)(CCCN)COC
InChIInChI=1S/C14H30FNO/c1-4-6-8-13(5-2)11-14(15,12-17-3)9-7-10-16/h13H,4-12,16H2,1-3H3
InChIKeyLEDYEZNVHPBLLI-UHFFFAOYSA-N
XLogP3.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.40
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Fluoro-6-(methoxymethyl)-4-methylcycloheptan-1-amine
CID 155259230
(2S)-2-fluoro-8-methoxy-3-methyloctan-4-amine
CID 163716390
12-Ethoxy-3-methyl-4-(3-methylbutan-2-yl)dodecan-1-amine
CID 109375
4-Methyl-2-[3-(2,2,2-trifluoroethoxy)propyl]pentan-1-amine
CID 62505704
2-Propyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62505889
2-Ethyl-5-(2,2,2-trifluoroethoxy)pentan-1-amine
CID 62505913
2-Methyl-8-(2,2,2-trifluoroethoxy)octan-3-amine
CID 64503225
2-Methyl-8-(2,2,2-trifluoroethoxy)octan-4-amine
CID 80435246
[3-(Difluoromethoxymethyl)cyclohexyl]methanamine
CID 84720022
2-[3-(Difluoromethoxymethyl)cyclohexyl]ethanamine
CID 84722403
4-Fluoro-4-(methoxymethyl)-6-methylnonan-1-amine
CID 103392364
4-Fluoro-4-(methoxymethyl)-6-methyloctan-1-amine
CID 103392386

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine?
The IUPAC name of 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine (CID 103392578) is 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine.
What is the SMILES notation for 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine?
The canonical SMILES for 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine is CCCCC(CC)CC(F)(CCCN)COC.
What is the InChIKey of 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine?
The InChIKey is LEDYEZNVHPBLLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30FNO/c1-4-6-8-13(5-2)11-14(15,12-17-3)9-7-10-16/h13H,4-12,16H2,1-3H3.
What are the key properties of 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine?
6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine has a molecular weight of 247.40 g/mol, XLogP of 3.69, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine is sourced from PubChem (CID 103392578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).