2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine

C15H14ClF2N — CID 107885041

IUPAC2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
SMILESCc1cc(F)cc(C(N)Cc2ccc(Cl)c(F)c2)c1
InChIInChI=1S/C15H14ClF2N/c1-9-4-11(8-12(17)5-9)15(19)7-10-2-3-13(16)14(18)6-10/h2-6,8,15H,7,19H2,1H3
InChIKeyWUVHACNOQJMEAB-UHFFFAOYSA-N
MW281.73 g/mol
LogP4.17
Rot. Bonds3

About 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine

2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine (PubChem CID 107885041) has the molecular formula C15H14ClF2N and a molecular weight of 281.73 g/mol. Its IUPAC name is 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
PubChem CID107885041
Molecular FormulaC15H14ClF2N
Molecular Weight281.73 g/mol
Exact Mass281.08
IUPAC Name2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
SMILESCc1cc(F)cc(C(N)Cc2ccc(Cl)c(F)c2)c1
InChIInChI=1S/C15H14ClF2N/c1-9-4-11(8-12(17)5-9)15(19)7-10-2-3-13(16)14(18)6-10/h2-6,8,15H,7,19H2,1H3
InChIKeyWUVHACNOQJMEAB-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

1-(3-bromo-5-methylphenyl)-2-(4-chloro-3-fluorophenyl)ethanamine
CID 107891519
2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanol
CID 107884328
1-(4-bromo-3,5-dimethylphenyl)-2-(4-chloro-3-fluorophenyl)ethanamine
CID 107885245
2-(3-chlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 79704483
2-(2,6-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 79704202
2-(4-chloro-3-fluorophenyl)-1-pyridin-4-ylethanamine
CID 114012684
(4-chloro-3-fluorophenyl)-(3-fluoro-5-methylphenyl)methanamine
CID 107994515
1-(3-bromo-4-chlorophenyl)-2-(4-chloro-3-fluorophenyl)ethanamine
CID 107885076
2-(3-chloro-4-fluorophenyl)-1-(4-chloro-3-fluorophenyl)ethanamine
CID 107995842
1-(4-chloro-3-fluorophenyl)-2-(4-chlorophenyl)ethanamine
CID 107988757
2-(3-chloro-4-fluorophenyl)-1-(4-methylphenyl)ethanamine
CID 103039768
2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 107885313

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine?
The IUPAC name of 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine (CID 107885041) is 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine?
The canonical SMILES for 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine is Cc1cc(F)cc(C(N)Cc2ccc(Cl)c(F)c2)c1.
What is the InChIKey of 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine?
The InChIKey is WUVHACNOQJMEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF2N/c1-9-4-11(8-12(17)5-9)15(19)7-10-2-3-13(16)14(18)6-10/h2-6,8,15H,7,19H2,1H3.
What are the key properties of 2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine?
2-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-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-(4-chloro-3-fluorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine is sourced from PubChem (CID 107885041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).