1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine

C15H16FN — CID 105408607

IUPAC1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
SMILESCNCc1ccc(C)c(-c2ccccc2F)c1
InChIInChI=1S/C15H16FN/c1-11-7-8-12(10-17-2)9-14(11)13-5-3-4-6-15(13)16/h3-9,17H,10H2,1-2H3
InChIKeyGWIQYYDCURLZOL-UHFFFAOYSA-N
MW229.30 g/mol
LogP3.52
Rot. Bonds3

About 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine

1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine (PubChem CID 105408607) has the molecular formula C15H16FN and a molecular weight of 229.30 g/mol. Its IUPAC name is 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
PubChem CID105408607
Molecular FormulaC15H16FN
Molecular Weight229.30 g/mol
Exact Mass229.13
IUPAC Name1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
SMILESCNCc1ccc(C)c(-c2ccccc2F)c1
InChIInChI=1S/C15H16FN/c1-11-7-8-12(10-17-2)9-14(11)13-5-3-4-6-15(13)16/h3-9,17H,10H2,1-2H3
InChIKeyGWIQYYDCURLZOL-UHFFFAOYSA-N
XLogP3.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[3-(2-fluorophenyl)-4-methylphenyl]methyl]propan-2-amine
CID 105408608
1-[4-fluoro-3-(5-fluoro-2-methylphenyl)phenyl]-N-methylmethanamine
CID 54911947
1-[3-(2,5-difluoro-4-methylphenyl)-4-methylphenyl]-N-methylmethanamine
CID 105410107
N-methyl-1-(4-methyl-3-naphthalen-1-ylphenyl)methanamine
CID 105408323
1-[3-(3-bromo-2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine
CID 106646455
1-[3-(4-chloronaphthalen-1-yl)-4-methylphenyl]-N-methylmethanamine
CID 105410094
1-[4-fluoro-3-(4-methylphenyl)phenyl]-N-methylmethanamine
CID 54911637
4-fluoro-2-(2-fluorophenyl)-1-methylbenzene
CID 46313938
2-(2-fluorophenyl)-1,4-dimethylbenzene
CID 66641436
1-[5-(2-fluorophenyl)thiophen-3-yl]-N-methylmethanamine
CID 62491192
N-[[4-fluoro-3-(2-fluorophenyl)phenyl]methyl]ethanamine
CID 62492408
1-[3-(2-chloro-4,5-dimethylphenyl)-4-methylphenyl]-N-methylmethanamine
CID 105410126

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine (CID 105408607) is 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine is CNCc1ccc(C)c(-c2ccccc2F)c1.
What is the InChIKey of 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine?
The InChIKey is GWIQYYDCURLZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN/c1-11-7-8-12(10-17-2)9-14(11)13-5-3-4-6-15(13)16/h3-9,17H,10H2,1-2H3.
What are the key properties of 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine?
1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine has a molecular weight of 229.30 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-fluorophenyl)-4-methylphenyl]-N-methylmethanamine is sourced from PubChem (CID 105408607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).