1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine

C15H15F2N — CID 61034414

IUPAC1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine
SMILESCNC(C)c1cccc(-c2ccc(F)cc2F)c1
InChIInChI=1S/C15H15F2N/c1-10(18-2)11-4-3-5-12(8-11)14-7-6-13(16)9-15(14)17/h3-10,18H,1-2H3
InChIKeyRJRZQAKJNIIHFE-UHFFFAOYSA-N
MW247.29 g/mol
LogP3.91
Rot. Bonds3

About 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine

1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine (PubChem CID 61034414) has the molecular formula C15H15F2N and a molecular weight of 247.29 g/mol. Its IUPAC name is 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine.

Molecular Properties

Compound Name1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine
PubChem CID61034414
Molecular FormulaC15H15F2N
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC Name1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine
SMILESCNC(C)c1cccc(-c2ccc(F)cc2F)c1
InChIInChI=1S/C15H15F2N/c1-10(18-2)11-4-3-5-12(8-11)14-7-6-13(16)9-15(14)17/h3-10,18H,1-2H3
InChIKeyRJRZQAKJNIIHFE-UHFFFAOYSA-N
XLogP3.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-(2,4-difluorophenyl)phenyl]-N-methylpropan-1-amine
CID 61033126
1-[3-(2,3-difluoro-4-methylphenyl)phenyl]-N-methylethanamine
CID 107514088
1-[3-(3-fluoro-2-methylphenyl)phenyl]-N-methylethanamine
CID 113324477
3-(2,4-difluorophenyl)phenol
CID 11356203
1-[3-(3-bromophenyl)phenyl]-N-methylethanamine
CID 113324687
1-[3-(4-bromophenyl)phenyl]-N-methylethanamine
CID 63888721
3-amino-3-[3-(2,4-difluorophenyl)phenyl]propanoic acid
CID 135367202
5-(2-aminoethoxy)-N-[(1R)-1-[3-(2,4-difluorophenyl)phenyl]ethyl]-2-methylbenzamide
CID 177380696
1-fluoro-2-(3-propan-2-ylphenyl)benzene
CID 20871867
1-[4-(1-bromoethyl)phenyl]-2,4-difluorobenzene
CID 21322621
N-methyl-1-[3-(6-methyl-3-pyridinyl)phenyl]ethanamine
CID 63157736
1-[3-[(2-bromo-4-fluorophenyl)methylsulfanyl]phenyl]-N-methylethanamine
CID 64661530

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine?
The IUPAC name of 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine (CID 61034414) is 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine.
What is the SMILES notation for 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine?
The canonical SMILES for 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine is CNC(C)c1cccc(-c2ccc(F)cc2F)c1.
What is the InChIKey of 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine?
The InChIKey is RJRZQAKJNIIHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2N/c1-10(18-2)11-4-3-5-12(8-11)14-7-6-13(16)9-15(14)17/h3-10,18H,1-2H3.
What are the key properties of 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine?
1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine has a molecular weight of 247.29 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,4-difluorophenyl)phenyl]-N-methylethanamine is sourced from PubChem (CID 61034414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).