2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide

C15H13F2NO — CID 58433967

IUPAC2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide
SMILESCNC(=O)C(F)c1ccccc1-c1cccc(F)c1
InChIInChI=1S/C15H13F2NO/c1-18-15(19)14(17)13-8-3-2-7-12(13)10-5-4-6-11(16)9-10/h2-9,14H,1H3,(H,18,19)
InChIKeyVINKBDCSDPCBRR-UHFFFAOYSA-N
MW261.27 g/mol
LogP3.25
Rot. Bonds3

About 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide

2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide (PubChem CID 58433967) has the molecular formula C15H13F2NO and a molecular weight of 261.27 g/mol. Its IUPAC name is 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide.

Molecular Properties

Compound Name2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide
PubChem CID58433967
Molecular FormulaC15H13F2NO
Molecular Weight261.27 g/mol
Exact Mass261.10
IUPAC Name2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide
SMILESCNC(=O)C(F)c1ccccc1-c1cccc(F)c1
InChIInChI=1S/C15H13F2NO/c1-18-15(19)14(17)13-8-3-2-7-12(13)10-5-4-6-11(16)9-10/h2-9,14H,1H3,(H,18,19)
InChIKeyVINKBDCSDPCBRR-UHFFFAOYSA-N
XLogP3.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide?
The IUPAC name of 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide (CID 58433967) is 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide.
What is the SMILES notation for 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide?
The canonical SMILES for 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide is CNC(=O)C(F)c1ccccc1-c1cccc(F)c1.
What is the InChIKey of 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide?
The InChIKey is VINKBDCSDPCBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO/c1-18-15(19)14(17)13-8-3-2-7-12(13)10-5-4-6-11(16)9-10/h2-9,14H,1H3,(H,18,19).
What are the key properties of 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide?
2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide has a molecular weight of 261.27 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-[2-(3-fluorophenyl)phenyl]-N-methylacetamide is sourced from PubChem (CID 58433967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).