N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide

C16H14ClF2NO3 — CID 51145397

IUPACN-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cc(Cl)ccc2C)c1OC(F)F
InChIInChI=1S/C16H14ClF2NO3/c1-9-6-7-10(17)8-12(9)20-15(21)11-4-3-5-13(22-2)14(11)23-16(18)19/h3-8,16H,1-2H3,(H,20,21)
InChIKeyJYXDACKXKNDMSN-UHFFFAOYSA-N
MW341.74 g/mol
LogP4.51
Rot. Bonds5

About N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide

N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide (PubChem CID 51145397) has the molecular formula C16H14ClF2NO3 and a molecular weight of 341.74 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide
PubChem CID51145397
Molecular FormulaC16H14ClF2NO3
Molecular Weight341.74 g/mol
Exact Mass341.06
IUPAC NameN-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cc(Cl)ccc2C)c1OC(F)F
InChIInChI=1S/C16H14ClF2NO3/c1-9-6-7-10(17)8-12(9)20-15(21)11-4-3-5-13(22-2)14(11)23-16(18)19/h3-8,16H,1-2H3,(H,20,21)
InChIKeyJYXDACKXKNDMSN-UHFFFAOYSA-N
XLogP4.51
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.74
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-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-(5-acetamido-2-fluorophenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 55551005
N-(5-fluoro-2-methylphenyl)-2,3-dimethoxybenzamide
CID 2443471
2-(difluoromethoxy)-3-methoxy-N-naphthalen-1-ylbenzamide
CID 112762767
N-[(3-chlorophenyl)methyl]-2-(difluoromethoxy)-3-methoxybenzamide
CID 51158712
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-(difluoromethoxy)-3-methoxybenzamide
CID 55341280
N-(3-bromophenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 51148287
N-[2-(2-amino-2-oxoethyl)phenyl]-2-(difluoromethoxy)-3-methoxybenzamide
CID 55670050
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
N-(2-benzylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 55331140
2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide
CID 51143865
2-(difluoromethoxy)-3-methoxy-N-(3-methylsulfanylphenyl)benzamide
CID 51149413
N-[3-chloro-4-(difluoromethoxy)phenyl]-2,3-dimethoxybenzamide
CID 26901544

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide (CID 51145397) is N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide is COc1cccc(C(=O)Nc2cc(Cl)ccc2C)c1OC(F)F.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide?
The InChIKey is JYXDACKXKNDMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClF2NO3/c1-9-6-7-10(17)8-12(9)20-15(21)11-4-3-5-13(22-2)14(11)23-16(18)19/h3-8,16H,1-2H3,(H,20,21).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide?
N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide has a molecular weight of 341.74 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide is sourced from PubChem (CID 51145397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).