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

C15H14ClF2N — CID 105032385

IUPAC2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
SMILESCc1cccc(C(N)Cc2cccc(F)c2Cl)c1F
InChIInChI=1S/C15H14ClF2N/c1-9-4-2-6-11(15(9)18)13(19)8-10-5-3-7-12(17)14(10)16/h2-7,13H,8,19H2,1H3
InChIKeyFDIBSOPIRGGHNC-UHFFFAOYSA-N
MW281.73 g/mol
LogP4.17
Rot. Bonds3

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

2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine (PubChem CID 105032385) has the molecular formula C15H14ClF2N and a molecular weight of 281.73 g/mol. Its IUPAC name is 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
PubChem CID105032385
Molecular FormulaC15H14ClF2N
Molecular Weight281.73 g/mol
Exact Mass281.08
IUPAC Name2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
SMILESCc1cccc(C(N)Cc2cccc(F)c2Cl)c1F
InChIInChI=1S/C15H14ClF2N/c1-9-4-2-6-11(15(9)18)13(19)8-10-5-3-7-12(17)14(10)16/h2-7,13H,8,19H2,1H3
InChIKeyFDIBSOPIRGGHNC-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-(2-chloro-3-fluorophenyl)-2-(3-chloro-2-fluorophenyl)ethanamine
CID 102866438
2-(2-chloro-3-fluorophenyl)-1-(2,5-dimethylphenyl)ethanamine
CID 105032399
1-(3-chloro-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 64713277
2-(2-chloro-3-fluorophenyl)-1-(2,5-dimethylfuran-3-yl)ethanamine
CID 105032520
2-(2-chloro-3-fluorophenyl)-1-(6-methyl-2-pyridinyl)ethanamine
CID 112653700
1-(3-chloro-2-fluorophenyl)-2-(2,5-dimethylphenyl)ethanamine
CID 64713976
2-(2-chloro-3-fluorophenyl)-1-(2-chloro-3-methylphenyl)-N-methylethanamine
CID 105032442
2-(2-chloro-3-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethanamine
CID 105178948
2-(2-chloro-3-fluorophenyl)-1-(2-methoxy-4-methylphenyl)ethanamine
CID 106791439
2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 107885313
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethanamine
CID 115983920
1-(4-bromo-3-methylphenyl)-2-(2-chloro-3-fluorophenyl)ethanamine
CID 105032643

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine?
The IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine (CID 105032385) is 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine is Cc1cccc(C(N)Cc2cccc(F)c2Cl)c1F.
What is the InChIKey of 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine?
The InChIKey is FDIBSOPIRGGHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF2N/c1-9-4-2-6-11(15(9)18)13(19)8-10-5-3-7-12(17)14(10)16/h2-7,13H,8,19H2,1H3.
What are the key properties of 2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine?
2-(2-chloro-3-fluorophenyl)-1-(2-fluoro-3-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-3-fluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine is sourced from PubChem (CID 105032385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).