3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide

C15H12F3NO — CID 78769060

IUPAC3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
SMILESCN(Cc1ccccc1F)C(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C15H12F3NO/c1-19(9-10-4-2-3-5-14(10)18)15(20)11-6-12(16)8-13(17)7-11/h2-8H,9H2,1H3
InChIKeySHBZPJVARFGTJM-UHFFFAOYSA-N
MW279.26 g/mol
LogP3.38
Rot. Bonds3

About 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide

3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide (PubChem CID 78769060) has the molecular formula C15H12F3NO and a molecular weight of 279.26 g/mol. Its IUPAC name is 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
PubChem CID78769060
Molecular FormulaC15H12F3NO
Molecular Weight279.26 g/mol
Exact Mass279.09
IUPAC Name3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
SMILESCN(Cc1ccccc1F)C(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C15H12F3NO/c1-19(9-10-4-2-3-5-14(10)18)15(20)11-6-12(16)8-13(17)7-11/h2-8H,9H2,1H3
InChIKeySHBZPJVARFGTJM-UHFFFAOYSA-N
XLogP3.38
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.26
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 60628244
N-[[2-(aminomethyl)phenyl]methyl]-3,5-difluoro-N-methylbenzamide
CID 60922714
N-[(2-fluorophenyl)methyl]-3,4,5-trimethoxy-N-methylbenzamide
CID 4780408
3-bromo-4-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 103706385
4-carbamothioyl-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 55729757
5,6-dichloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60628265
2-chloro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-4-carboxamide
CID 60692943
(2-fluorophenyl)methyl-methylcarbamic acid
CID 115171049
2-bromo-6-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 115678174
2-chloro-4-fluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide
CID 78768857
N-[(2-fluorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
CID 134057045
N-[(2-fluorophenyl)methyl]-N-methylcarbamoyl chloride
CID 79886378

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide?
The IUPAC name of 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide (CID 78769060) is 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide?
The canonical SMILES for 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide is CN(Cc1ccccc1F)C(=O)c1cc(F)cc(F)c1.
What is the InChIKey of 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide?
The InChIKey is SHBZPJVARFGTJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO/c1-19(9-10-4-2-3-5-14(10)18)15(20)11-6-12(16)8-13(17)7-11/h2-8H,9H2,1H3.
What are the key properties of 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide?
3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide has a molecular weight of 279.26 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-[(2-fluorophenyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 78769060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).