2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine

C15H15ClFNO — CID 43561283

IUPAC2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(N)Cc2ccc(Cl)cc2)c(F)c1
InChIInChI=1S/C15H15ClFNO/c1-19-12-6-7-13(14(17)9-12)15(18)8-10-2-4-11(16)5-3-10/h2-7,9,15H,8,18H2,1H3
InChIKeyJOUCFJBANABDHA-UHFFFAOYSA-N
MW279.74 g/mol
LogP3.73
Rot. Bonds4

About 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine

2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine (PubChem CID 43561283) has the molecular formula C15H15ClFNO and a molecular weight of 279.74 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
PubChem CID43561283
Molecular FormulaC15H15ClFNO
Molecular Weight279.74 g/mol
Exact Mass279.08
IUPAC Name2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
SMILESCOc1ccc(C(N)Cc2ccc(Cl)cc2)c(F)c1
InChIInChI=1S/C15H15ClFNO/c1-19-12-6-7-13(14(17)9-12)15(18)8-10-2-4-11(16)5-3-10/h2-7,9,15H,8,18H2,1H3
InChIKeyJOUCFJBANABDHA-UHFFFAOYSA-N
XLogP3.73
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.74
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-fluoro-4-methoxyphenyl)-2-(4-fluorophenyl)ethanamine
CID 43561226
2-(4-bromophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 43561233
2-(3,5-dimethylphenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 81304819
2-(4-methoxyphenyl)-1-(2,4,5-trifluorophenyl)ethanamine
CID 103301772
1-(2-fluoro-4-methoxyphenyl)-2-(furan-3-yl)ethanamine
CID 83182670
1-(2-fluoro-4-methoxyphenyl)-2-(3-methylphenyl)ethanamine
CID 55067518
2-amino-2-(2-fluoro-4-methoxyphenyl)ethanol
CID 55272766
(1S)-1-(2-fluoro-4-methoxyphenyl)propane-1,3-diamine
CID 171219591
2-(2-bromo-5-methoxyphenyl)-1-(4-chloro-2-fluorophenyl)ethanamine
CID 65325566
1-(2,4-difluoro-5-methylphenyl)-2-(4-methoxyphenyl)ethanamine
CID 79724876
1-(5-bromo-4-fluoro-2-methoxyphenyl)-2-(4-chlorophenyl)ethanamine
CID 103394333
(1R)-1-(2-fluoro-4-methoxyphenyl)pentan-1-amine;hydrochloride
CID 171200074

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine?
The IUPAC name of 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine (CID 43561283) is 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine is COc1ccc(C(N)Cc2ccc(Cl)cc2)c(F)c1.
What is the InChIKey of 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine?
The InChIKey is JOUCFJBANABDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFNO/c1-19-12-6-7-13(14(17)9-12)15(18)8-10-2-4-11(16)5-3-10/h2-7,9,15H,8,18H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine?
2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine has a molecular weight of 279.74 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine is sourced from PubChem (CID 43561283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).