N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide

C15H12F3NO3 — CID 31079743

IUPACN-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H12F3NO3/c1-21-12-7-6-9(16)8-10(12)14(20)19-11-4-2-3-5-13(11)22-15(17)18/h2-8,15H,1H3,(H,19,20)
InChIKeyPUTUPISFEPEHCA-UHFFFAOYSA-N
MW311.26 g/mol
LogP3.69
Rot. Bonds5

About N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide

N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide (PubChem CID 31079743) has the molecular formula C15H12F3NO3 and a molecular weight of 311.26 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide
PubChem CID31079743
Molecular FormulaC15H12F3NO3
Molecular Weight311.26 g/mol
Exact Mass311.08
IUPAC NameN-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C15H12F3NO3/c1-21-12-7-6-9(16)8-10(12)14(20)19-11-4-2-3-5-13(11)22-15(17)18/h2-8,15H,1H3,(H,19,20)
InChIKeyPUTUPISFEPEHCA-UHFFFAOYSA-N
XLogP3.69
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.26
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide 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

N-[2-(difluoromethoxy)phenyl]-2,4,5-trimethoxybenzamide
CID 17394633
5-fluoro-2-methoxy-N-(2-methylphenyl)benzamide
CID 31065487
4-(difluoromethoxy)-N-[2-(difluoromethoxy)phenyl]-3-methoxybenzamide
CID 8502681
[2-(difluoromethoxy)phenyl]-(5-fluoro-2-methoxyphenyl)methanone
CID 43339634
2-(difluoromethoxy)-N-(2-methoxy-5-methylphenyl)benzamide
CID 2441885
N-(2-cyclopentylsulfanylphenyl)-5-fluoro-2-methoxybenzamide
CID 55615222
N-[[2-(difluoromethoxy)phenyl]carbamothioyl]-3-methoxynaphthalene-2-carboxamide
CID 1396157
methyl 2-[(2,5-difluorobenzoyl)amino]-4-(difluoromethoxy)-5-methoxybenzoate
CID 55519622
4-cyano-N-[2-(difluoromethoxy)phenyl]-2-fluorobenzamide
CID 953070
N-[2-(difluoromethoxy)phenyl]-2-ethoxybenzamide
CID 17394090
5-amino-N-[2-(difluoromethoxy)phenyl]-2-methylbenzamide
CID 61290396
N-(4-acetamidophenyl)-5-fluoro-2-methoxybenzamide
CID 31063829

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide (CID 31079743) is N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide is COc1ccc(F)cc1C(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide?
The InChIKey is PUTUPISFEPEHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO3/c1-21-12-7-6-9(16)8-10(12)14(20)19-11-4-2-3-5-13(11)22-15(17)18/h2-8,15H,1H3,(H,19,20).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide?
N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide has a molecular weight of 311.26 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-5-fluoro-2-methoxybenzamide is sourced from PubChem (CID 31079743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).