1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone

C16H15F2NO — CID 60650512

IUPAC1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone
SMILESCN(CC(=O)c1ccc(F)cc1)Cc1ccccc1F
InChIInChI=1S/C16H15F2NO/c1-19(10-13-4-2-3-5-15(13)18)11-16(20)12-6-8-14(17)9-7-12/h2-9H,10-11H2,1H3
InChIKeyQAFQSDBYQVGZNR-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.28
Rot. Bonds5

About 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone

1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone (PubChem CID 60650512) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone
PubChem CID60650512
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC Name1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone
SMILESCN(CC(=O)c1ccc(F)cc1)Cc1ccccc1F
InChIInChI=1S/C16H15F2NO/c1-19(10-13-4-2-3-5-15(13)18)11-16(20)12-6-8-14(17)9-7-12/h2-9H,10-11H2,1H3
InChIKeyQAFQSDBYQVGZNR-UHFFFAOYSA-N
XLogP3.28
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[(2-fluorophenyl)methyl-methylamino]acetyl]benzonitrile
CID 62035950
4-[(2-fluorophenyl)methyl-methylamino]-1-phenylbutan-1-one
CID 60692532
1-(4-fluorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]ethanone
CID 60650449
1-(2,5-dichlorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone
CID 62037111
2-[(2-fluorophenyl)methyl-methylamino]-1-(4-nitro-1H-pyrrol-2-yl)ethanone
CID 62037696
N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 78791355
4-[[(2-fluorophenyl)methyl-methylamino]methyl]benzohydrazide
CID 63583693
2-[(3-bromophenyl)methyl-methylamino]-1-(4-fluorophenyl)ethanone
CID 62035174
2-[(2-fluorophenyl)methyl-methylamino]-1-(2-phenyl-1H-indol-3-yl)ethanone
CID 18275114
propan-2-yl 2-[(2-fluorophenyl)methyl-methylamino]acetate
CID 54940308
2-[(4-fluorophenyl)methyl-methylamino]-1-(4-methoxyphenyl)ethanone
CID 60650628
1-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl-methylamino]ethanone
CID 60650801

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone?
The IUPAC name of 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone (CID 60650512) is 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone?
The canonical SMILES for 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone is CN(CC(=O)c1ccc(F)cc1)Cc1ccccc1F.
What is the InChIKey of 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone?
The InChIKey is QAFQSDBYQVGZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-19(10-13-4-2-3-5-15(13)18)11-16(20)12-6-8-14(17)9-7-12/h2-9H,10-11H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone?
1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone has a molecular weight of 275.30 g/mol, XLogP of 3.28, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]ethanone is sourced from PubChem (CID 60650512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).