N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide

C15H13F2NO2 — CID 9210303

IUPACN-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H13F2NO2/c1-9-3-6-14(20-2)11(7-9)15(19)18-10-4-5-12(16)13(17)8-10/h3-8H,1-2H3,(H,18,19)
InChIKeyUFXPVMMXEBJAAV-UHFFFAOYSA-N
MW277.27 g/mol
LogP3.53
Rot. Bonds3

About N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide

N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide (PubChem CID 9210303) has the molecular formula C15H13F2NO2 and a molecular weight of 277.27 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide
PubChem CID9210303
Molecular FormulaC15H13F2NO2
Molecular Weight277.27 g/mol
Exact Mass277.09
IUPAC NameN-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H13F2NO2/c1-9-3-6-14(20-2)11(7-9)15(19)18-10-4-5-12(16)13(17)8-10/h3-8H,1-2H3,(H,18,19)
InChIKeyUFXPVMMXEBJAAV-UHFFFAOYSA-N
XLogP3.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
N-(3-bromo-4-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 63999813
N-(3-fluoro-4-methoxyphenyl)-2-hydroxy-5-methylbenzamide
CID 43381005
N-(3,4-difluorophenyl)-5-[(4-fluorophenyl)methyl]-2-methoxybenzamide
CID 46949187
N-(4-ethoxy-3-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 115678718
methyl 4-[(2-methoxy-5-methylbenzoyl)amino]benzoate
CID 9043924
N-(3-bromo-4-fluorophenyl)-2,5-dimethoxybenzamide
CID 115661440
N-(3-chloro-4-hydroxyphenyl)-2-methoxy-5-methylbenzamide
CID 63937740
N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
CID 79770618
2-fluoro-N-(3-fluoro-4-hydroxyphenyl)-5-methylbenzamide
CID 64780308
N-(3,4-difluorophenyl)-2-methoxy-5-(3-methylbutan-2-ylsulfamoyl)benzamide
CID 118677106
2-methoxy-5-methyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 35624437

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide (CID 9210303) is N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide is COc1ccc(C)cc1C(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide?
The InChIKey is UFXPVMMXEBJAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c1-9-3-6-14(20-2)11(7-9)15(19)18-10-4-5-12(16)13(17)8-10/h3-8H,1-2H3,(H,18,19).
What are the key properties of N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide?
N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide has a molecular weight of 277.27 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 9210303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).