N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide

C17H18ClNO5 — CID 1228238

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(Cl)c(OC)cc2OC)c1
InChIInChI=1S/C17H18ClNO5/c1-21-11-5-10(6-12(7-11)22-2)17(20)19-14-8-13(18)15(23-3)9-16(14)24-4/h5-9H,1-4H3,(H,19,20)
InChIKeyDFSYPYGPYDYWSL-UHFFFAOYSA-N
MW351.79 g/mol
LogP3.63
Rot. Bonds6

About N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide

N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide (PubChem CID 1228238) has the molecular formula C17H18ClNO5 and a molecular weight of 351.79 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide
PubChem CID1228238
Molecular FormulaC17H18ClNO5
Molecular Weight351.79 g/mol
Exact Mass351.09
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2cc(Cl)c(OC)cc2OC)c1
InChIInChI=1S/C17H18ClNO5/c1-21-11-5-10(6-12(7-11)22-2)17(20)19-14-8-13(18)15(23-3)9-16(14)24-4/h5-9H,1-4H3,(H,19,20)
InChIKeyDFSYPYGPYDYWSL-UHFFFAOYSA-N
XLogP3.63
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.79
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide 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-(2,4-dimethoxyphenyl)-4-methylbenzamide
CID 710605
N-(2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide
CID 2321450
N-(5-Chloro-2,4-dimethoxyphenyl)-2-fluorobenzamide
CID 836294
N-(5-chloro-2,4-dimethoxyphenyl)-2-phenylbutanamide
CID 2922753
4-(5-Chloro-2,4-dimethoxyanilino)naphthalene-1,2-dione
CID 671256
N-(5-chloro-2,4-dimethoxyphenyl)-3-fluorobenzamide
CID 835624
N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-methylphenoxy)acetamide
CID 836312
N-(3-chloro-4-methoxyphenyl)-3-(difluoromethoxy)benzamide
CID 843446
4-chloro-N-[4-(2,4-dimethoxyanilino)-4-oxobutyl]benzamide
CID 4827354
N-benzyl-2-(5-chloro-2,4-dimethoxyanilino)propanamide
CID 4880305
1-(5-Chloro-2,4-dimethoxyphenyl)-1-methyl-3-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-YL]urea
CID 16023448
N-(5-chloro-2,4-dimethoxyphenyl)-4-(4-methoxyphenyl)-2,4-dioxobutanamide
CID 16193055

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide (CID 1228238) is N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)Nc2cc(Cl)c(OC)cc2OC)c1.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide?
The InChIKey is DFSYPYGPYDYWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO5/c1-21-11-5-10(6-12(7-11)22-2)17(20)19-14-8-13(18)15(23-3)9-16(14)24-4/h5-9H,1-4H3,(H,19,20).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide?
N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide has a molecular weight of 351.79 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-3,5-dimethoxybenzamide is sourced from PubChem (CID 1228238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).