1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine

C11H16FNO — CID 55273260

IUPAC1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine
SMILESCCc1ccc(F)cc1C(N)COC
InChIInChI=1S/C11H16FNO/c1-3-8-4-5-9(12)6-10(8)11(13)7-14-2/h4-6,11H,3,7,13H2,1-2H3
InChIKeyXDCKHIXNJKQCDF-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.03
Rot. Bonds4

About 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine

1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine (PubChem CID 55273260) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine.

Molecular Properties

Compound Name1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine
PubChem CID55273260
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine
SMILESCCc1ccc(F)cc1C(N)COC
InChIInChI=1S/C11H16FNO/c1-3-8-4-5-9(12)6-10(8)11(13)7-14-2/h4-6,11H,3,7,13H2,1-2H3
InChIKeyXDCKHIXNJKQCDF-UHFFFAOYSA-N
XLogP2.03
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-ethyl-5-fluorophenyl)butan-1-amine
CID 55268868
(1S)-1-(2-ethyl-5-fluorophenyl)ethanamine
CID 130619359
(1R)-1-(2-ethylphenyl)-2-methoxyethanamine
CID 146013091
(3S)-3-amino-3-(2-ethyl-5-fluorophenyl)propanenitrile
CID 130658086
4-[(1S)-1-amino-2-methoxyethyl]-3-ethylphenol
CID 55268338
(R)-cyclopropyl-(2-ethyl-5-fluorophenyl)methanamine
CID 131122532
4-(2,4-difluorophenyl)-1-methoxybutan-2-amine
CID 62318724
1-(3-fluorophenyl)-2-methoxyethanamine
CID 45283501
1-(5-fluoro-1-benzofuran-2-yl)-2-methoxyethanamine
CID 114728098
(1R)-1-(3,5-difluorophenyl)-2-methoxyethanamine
CID 55272435
(1R)-1-[5-fluoro-2-(1-methoxypropan-2-yloxy)phenyl]ethanamine
CID 78956396
1-(4-bromo-2-fluorophenyl)-2-methoxyethanamine
CID 112693311

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine?
The IUPAC name of 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine (CID 55273260) is 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine.
What is the SMILES notation for 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine?
The canonical SMILES for 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine is CCc1ccc(F)cc1C(N)COC.
What is the InChIKey of 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine?
The InChIKey is XDCKHIXNJKQCDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-3-8-4-5-9(12)6-10(8)11(13)7-14-2/h4-6,11H,3,7,13H2,1-2H3.
What are the key properties of 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine?
1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine has a molecular weight of 197.25 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-5-fluorophenyl)-2-methoxyethanamine is sourced from PubChem (CID 55273260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).