2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine

C15H14ClF2N — CID 55138858

IUPAC2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
SMILESCc1ccc(C(N)Cc2c(F)cccc2Cl)cc1F
InChIInChI=1S/C15H14ClF2N/c1-9-5-6-10(7-14(9)18)15(19)8-11-12(16)3-2-4-13(11)17/h2-7,15H,8,19H2,1H3
InChIKeyQURAKLVTIHLSIC-UHFFFAOYSA-N
MW281.73 g/mol
LogP4.17
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine

2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine (PubChem CID 55138858) has the molecular formula C15H14ClF2N and a molecular weight of 281.73 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
PubChem CID55138858
Molecular FormulaC15H14ClF2N
Molecular Weight281.73 g/mol
Exact Mass281.08
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
SMILESCc1ccc(C(N)Cc2c(F)cccc2Cl)cc1F
InChIInChI=1S/C15H14ClF2N/c1-9-5-6-10(7-14(9)18)15(19)8-11-12(16)3-2-4-13(11)17/h2-7,15H,8,19H2,1H3
InChIKeyQURAKLVTIHLSIC-UHFFFAOYSA-N
XLogP4.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.73
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,6-dichlorophenyl)-1-(3,4-difluorophenyl)ethanamine
CID 62600681
3-[1-amino-2-(2-chloro-6-fluorophenyl)ethyl]-N,N-dimethylaniline
CID 105105636
2-(2-chloro-5-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine
CID 102618457
1-(2-chloro-6-fluorophenyl)-3-(3,4-dimethylphenyl)propan-2-amine
CID 62899971
2-(2,6-dichlorophenyl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 115830327
2-(2,6-dichlorophenyl)-1-(2,4-difluoro-5-methylphenyl)ethanamine
CID 115830073
(4-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 107996089
2-[2-bromo-2-(4-fluoro-3-methylphenyl)ethyl]-1-chloro-3-fluorobenzene
CID 63517979
2-(2,6-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 79704202
1-(3-fluoro-4-methylphenyl)-2-(3-methoxyphenyl)ethanamine
CID 61078688
5-(2-chloro-6-fluorophenyl)-4-methylpentan-2-amine
CID 64721399
2-(2-chloro-6-fluorophenyl)-1-(4-methylphenyl)ethanol
CID 61100900

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine (CID 55138858) is 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine is Cc1ccc(C(N)Cc2c(F)cccc2Cl)cc1F.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine?
The InChIKey is QURAKLVTIHLSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF2N/c1-9-5-6-10(7-14(9)18)15(19)8-11-12(16)3-2-4-13(11)17/h2-7,15H,8,19H2,1H3.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine?
2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine has a molecular weight of 281.73 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanamine is sourced from PubChem (CID 55138858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).