N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine

C17H19F2NO — CID 63934918

IUPACN-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1cc(F)ccc1OCc1ccccc1F
InChIInChI=1S/C17H19F2NO/c1-3-20-12(2)15-10-14(18)8-9-17(15)21-11-13-6-4-5-7-16(13)19/h4-10,12,20H,3,11H2,1-2H3
InChIKeyJHQUFFUEKUYNCH-UHFFFAOYSA-N
MW291.34 g/mol
LogP4.21
Rot. Bonds6

About N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine

N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine (PubChem CID 63934918) has the molecular formula C17H19F2NO and a molecular weight of 291.34 g/mol. Its IUPAC name is N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
PubChem CID63934918
Molecular FormulaC17H19F2NO
Molecular Weight291.34 g/mol
Exact Mass291.14
IUPAC NameN-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
SMILESCCNC(C)c1cc(F)ccc1OCc1ccccc1F
InChIInChI=1S/C17H19F2NO/c1-3-20-12(2)15-10-14(18)8-9-17(15)21-11-13-6-4-5-7-16(13)19/h4-10,12,20H,3,11H2,1-2H3
InChIKeyJHQUFFUEKUYNCH-UHFFFAOYSA-N
XLogP4.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.34
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-[2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
CID 43279629
N-ethyl-1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]ethanamine
CID 43505172
1-[2-[(2-bromo-4-fluorophenyl)methoxy]phenyl]-N-ethylethanamine
CID 63499357
1-[2-[(2-chlorophenyl)methoxy]-4-fluorophenyl]-N-ethylethanamine
CID 63487243
N-ethyl-1-(5-fluoro-2-pentoxyphenyl)ethanamine
CID 43286048
N-ethyl-1-[5-fluoro-2-(2-methoxyethoxy)phenyl]ethanamine
CID 43285224
N-ethyl-1-[5-fluoro-2-[(5-methyl-3-pyridinyl)methoxy]phenyl]ethanamine
CID 102880480
2-[2-[1-(ethylamino)ethyl]-4-fluorophenoxy]benzonitrile
CID 43285237
N-ethyl-1-[5-fluoro-2-(2-methylbutan-2-yloxy)phenyl]ethanamine
CID 43285833
N-ethyl-1-[5-fluoro-2-[2-(3-methoxypropoxy)ethoxy]phenyl]ethanamine
CID 103177883
1-[2-[(2-fluorophenyl)methoxy]phenyl]propan-1-amine
CID 18071110
N-[[2-[(2,4-difluorophenyl)methoxy]phenyl]methyl]propan-2-amine
CID 62198279

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine?
The IUPAC name of N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine (CID 63934918) is N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine?
The canonical SMILES for N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine is CCNC(C)c1cc(F)ccc1OCc1ccccc1F.
What is the InChIKey of N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine?
The InChIKey is JHQUFFUEKUYNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F2NO/c1-3-20-12(2)15-10-14(18)8-9-17(15)21-11-13-6-4-5-7-16(13)19/h4-10,12,20H,3,11H2,1-2H3.
What are the key properties of N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine?
N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine has a molecular weight of 291.34 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-fluoro-2-[(2-fluorophenyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 63934918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).