1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine

C15H15F2N — CID 61078898

IUPAC1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1c(F)cccc1F
InChIInChI=1S/C15H15F2N/c1-10-5-2-3-6-11(10)9-14(18)15-12(16)7-4-8-13(15)17/h2-8,14H,9,18H2,1H3
InChIKeyNMNOAFHNPGVVKU-UHFFFAOYSA-N
MW247.29 g/mol
LogP3.52
Rot. Bonds3

About 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine

1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine (PubChem CID 61078898) has the molecular formula C15H15F2N and a molecular weight of 247.29 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine
PubChem CID61078898
Molecular FormulaC15H15F2N
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1c(F)cccc1F
InChIInChI=1S/C15H15F2N/c1-10-5-2-3-6-11(10)9-14(18)15-12(16)7-4-8-13(15)17/h2-8,14H,9,18H2,1H3
InChIKeyNMNOAFHNPGVVKU-UHFFFAOYSA-N
XLogP3.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-bromo-2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine
CID 106942346
1-(2-bromo-6-fluorophenyl)-2-(2,5-dimethylphenyl)ethanamine
CID 114559956
(1R)-1-[2-fluoro-6-[(2-methylphenyl)methylsulfanyl]phenyl]ethanamine
CID 55184818
1-(2-bromo-6-fluorophenyl)-2-(2,6-dimethylphenyl)ethanamine
CID 114886689
2-(2-bromo-3-fluorophenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105020643
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethanamine
CID 115983920
1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105376936
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 105032385
2-(2,3-difluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81279328
2-(3-chloro-2-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethanamine
CID 102857818
1-(4-fluoro-2-methylphenyl)-3-(2-methylphenyl)propan-2-amine
CID 114347770
1-(2,6-difluoro-3-methylphenyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 105051267

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine (CID 61078898) is 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine is Cc1ccccc1CC(N)c1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine?
The InChIKey is NMNOAFHNPGVVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N/c1-10-5-2-3-6-11(10)9-14(18)15-12(16)7-4-8-13(15)17/h2-8,14H,9,18H2,1H3.
What are the key properties of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine?
1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine has a molecular weight of 247.29 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 61078898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).