1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine

C15H14Cl2FN — CID 105376936

IUPAC1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
SMILESCc1ccc(F)cc1CC(N)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H14Cl2FN/c1-9-5-6-11(18)7-10(9)8-14(19)15-12(16)3-2-4-13(15)17/h2-7,14H,8,19H2,1H3
InChIKeyOXVAVEQYHFGNHA-UHFFFAOYSA-N
MW298.19 g/mol
LogP4.68
Rot. Bonds3

About 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine

1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine (PubChem CID 105376936) has the molecular formula C15H14Cl2FN and a molecular weight of 298.19 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
PubChem CID105376936
Molecular FormulaC15H14Cl2FN
Molecular Weight298.19 g/mol
Exact Mass297.05
IUPAC Name1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
SMILESCc1ccc(F)cc1CC(N)c1c(Cl)cccc1Cl
InChIInChI=1S/C15H14Cl2FN/c1-9-5-6-11(18)7-10(9)8-14(19)15-12(16)3-2-4-13(15)17/h2-7,14H,8,19H2,1H3
InChIKeyOXVAVEQYHFGNHA-UHFFFAOYSA-N
XLogP4.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.19
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chloro-3-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 107995696
1-(2,3-dimethylphenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105377287
1-(3,5-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373778
1-(2,6-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 61079265
1-(3-bromo-4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105374267
2-(5-fluoro-2-methylphenyl)-1-pyrimidin-2-ylethanamine
CID 105373657
1-(3-chloro-2-fluorophenyl)-2-(2,5-dimethylphenyl)ethanamine
CID 64713976
1-(3-chloro-2-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 107103532
1-(2-chloro-5-fluorophenyl)-3-(2-methylphenyl)propan-2-amine
CID 102618765
1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105373640
1-(5-fluoro-2-methylphenyl)-3-(3-fluorophenyl)propan-2-amine
CID 105373749
2-(2-chloro-5-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
CID 102618457

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine?
The IUPAC name of 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine (CID 105376936) is 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine?
The canonical SMILES for 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine is Cc1ccc(F)cc1CC(N)c1c(Cl)cccc1Cl.
What is the InChIKey of 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine?
The InChIKey is OXVAVEQYHFGNHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2FN/c1-9-5-6-11(18)7-10(9)8-14(19)15-12(16)3-2-4-13(15)17/h2-7,14H,8,19H2,1H3.
What are the key properties of 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine?
1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine has a molecular weight of 298.19 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine is sourced from PubChem (CID 105376936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).