N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide

C15H13F2NO3 — CID 17400602

IUPACN-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide
SMILESCOc1cc(NC(=O)c2cc(F)ccc2F)cc(OC)c1
InChIInChI=1S/C15H13F2NO3/c1-20-11-6-10(7-12(8-11)21-2)18-15(19)13-5-9(16)3-4-14(13)17/h3-8H,1-2H3,(H,18,19)
InChIKeyYKXXGBBMJMTSFU-UHFFFAOYSA-N
MW293.27 g/mol
LogP3.23
Rot. Bonds4

About N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide

N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide (PubChem CID 17400602) has the molecular formula C15H13F2NO3 and a molecular weight of 293.27 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide
PubChem CID17400602
Molecular FormulaC15H13F2NO3
Molecular Weight293.27 g/mol
Exact Mass293.09
IUPAC NameN-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide
SMILESCOc1cc(NC(=O)c2cc(F)ccc2F)cc(OC)c1
InChIInChI=1S/C15H13F2NO3/c1-20-11-6-10(7-12(8-11)21-2)18-15(19)13-5-9(16)3-4-14(13)17/h3-8H,1-2H3,(H,18,19)
InChIKeyYKXXGBBMJMTSFU-UHFFFAOYSA-N
XLogP3.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.27
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dimethoxyphenyl)-5-fluoro-2-methylbenzamide
CID 33219668
N-(3,5-dimethoxyphenyl)-2,3,4,5-tetrafluorobenzamide
CID 7960826
2,5-difluoro-N-(4-methylsulfanylphenyl)benzamide
CID 42370376
3-bromo-N-(3,5-dimethoxyphenyl)-4-fluorobenzamide
CID 103706313
N-(3-bromo-4-fluorophenyl)-2,5-difluorobenzamide
CID 115661483
2,5-difluoro-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 78802909
N-(3-bromo-5-methoxyphenyl)-2-fluoro-4-methoxybenzamide
CID 103876604
2-amino-N-(3-bromo-5-methoxyphenyl)-4-fluorobenzamide
CID 82859029
N-(3,5-dimethoxyphenyl)-2-methylbenzamide
CID 9096893
2-fluoro-N-(3-methoxyphenyl)benzamide
CID 2292975
2,5-difluoro-N-(3-hydroxy-4-methylphenyl)benzamide
CID 64793823
N-(2-chloro-4,5-dimethoxyphenyl)-2,5-difluorobenzamide
CID 18139978

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide (CID 17400602) is N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide is COc1cc(NC(=O)c2cc(F)ccc2F)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide?
The InChIKey is YKXXGBBMJMTSFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO3/c1-20-11-6-10(7-12(8-11)21-2)18-15(19)13-5-9(16)3-4-14(13)17/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide?
N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide has a molecular weight of 293.27 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-2,5-difluorobenzamide is sourced from PubChem (CID 17400602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).