2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide

C16H15F2NO — CID 78771203

IUPAC2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(F)cc1)C(=O)Cc1ccccc1F
InChIInChI=1S/C16H15F2NO/c1-19(11-12-6-8-14(17)9-7-12)16(20)10-13-4-2-3-5-15(13)18/h2-9H,10-11H2,1H3
InChIKeyGGHIYONZRHWGAW-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.17
Rot. Bonds4

About 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide

2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide (PubChem CID 78771203) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
PubChem CID78771203
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC Name2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(F)cc1)C(=O)Cc1ccccc1F
InChIInChI=1S/C16H15F2NO/c1-19(11-12-6-8-14(17)9-7-12)16(20)10-13-4-2-3-5-15(13)18/h2-9H,10-11H2,1H3
InChIKeyGGHIYONZRHWGAW-UHFFFAOYSA-N
XLogP3.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide (CID 78771203) is 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide is CN(Cc1ccc(F)cc1)C(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide?
The InChIKey is GGHIYONZRHWGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-19(11-12-6-8-14(17)9-7-12)16(20)10-13-4-2-3-5-15(13)18/h2-9H,10-11H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide?
2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide has a molecular weight of 275.30 g/mol, XLogP of 3.17, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 78771203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).