1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine

C14H13F2N — CID 81447035

IUPAC1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine
SMILESCNCc1ccc(-c2ccc(F)cc2)c(F)c1
InChIInChI=1S/C14H13F2N/c1-17-9-10-2-7-13(14(16)8-10)11-3-5-12(15)6-4-11/h2-8,17H,9H2,1H3
InChIKeyUJHBREYXMBUZCL-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.35
Rot. Bonds3

About 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine

1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine (PubChem CID 81447035) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine
PubChem CID81447035
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC Name1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine
SMILESCNCc1ccc(-c2ccc(F)cc2)c(F)c1
InChIInChI=1S/C14H13F2N/c1-17-9-10-2-7-13(14(16)8-10)11-3-5-12(15)6-4-11/h2-8,17H,9H2,1H3
InChIKeyUJHBREYXMBUZCL-UHFFFAOYSA-N
XLogP3.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine 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-[3-fluoro-4-[4-(2-methylbutan-2-yl)phenyl]phenyl]-N-methylmethanamine
CID 81440632
1-[3-fluoro-4-(2,4,6-trifluorophenyl)phenyl]-N-methylmethanamine
CID 81447979
1-[4-fluoro-3-(4-methylphenyl)phenyl]-N-methylmethanamine
CID 54911637
1-[4-(4-fluoro-2-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 66481802
1-[4-(2,4-dimethylphenyl)-3-fluorophenyl]-N-methylmethanamine
CID 81446952
1-[4-(2,6-dimethoxyphenyl)-3-fluorophenyl]-N-methylmethanamine
CID 116810918
1-[4-(2-chloro-4,5-dimethylphenyl)-3-fluorophenyl]-N-methylmethanamine
CID 115484339
1-[4-(5-fluoro-2-methoxyphenyl)phenyl]-N-methylmethanamine
CID 54910277
4-ethyl-1-[4-(4-ethylphenyl)phenyl]-2-fluorobenzene
CID 129263989
1-[3-(4-butylphenyl)-4-fluorophenyl]-N-methylmethanamine
CID 63424877
1-[4-fluoro-3-(5-fluoro-2-methylphenyl)phenyl]-N-methylmethanamine
CID 54911947
1-[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 79690685

Frequently Asked Questions

What is the IUPAC name of 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine (CID 81447035) is 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine is CNCc1ccc(-c2ccc(F)cc2)c(F)c1.
What is the InChIKey of 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine?
The InChIKey is UJHBREYXMBUZCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c1-17-9-10-2-7-13(14(16)8-10)11-3-5-12(15)6-4-11/h2-8,17H,9H2,1H3.
What are the key properties of 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine?
1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine has a molecular weight of 233.26 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-fluoro-4-(4-fluorophenyl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 81447035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).