N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide

C16H16ClNO4 — CID 795184

IUPACN-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1Cl
InChIInChI=1S/C16H16ClNO4/c1-20-13-7-5-11(9-12(13)17)18-16(19)10-4-6-14(21-2)15(8-10)22-3/h4-9H,1-3H3,(H,18,19)
InChIKeyFUDNAYXLBLVEOR-UHFFFAOYSA-N
MW321.76 g/mol
LogP3.62
Rot. Bonds5

About N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide

N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide (PubChem CID 795184) has the molecular formula C16H16ClNO4 and a molecular weight of 321.76 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
PubChem CID795184
Molecular FormulaC16H16ClNO4
Molecular Weight321.76 g/mol
Exact Mass321.08
IUPAC NameN-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
SMILESCOc1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1Cl
InChIInChI=1S/C16H16ClNO4/c1-20-13-7-5-11(9-12(13)17)18-16(19)10-4-6-14(21-2)15(8-10)22-3/h4-9H,1-3H3,(H,18,19)
InChIKeyFUDNAYXLBLVEOR-UHFFFAOYSA-N
XLogP3.62
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.76
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-methoxyphenyl)-3,4-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-[(3-chloro-4-methoxyphenyl)carbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 2185661
4-bromo-3-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 81307448
N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide
CID 3529705
N-(3-chloro-4-methoxyphenyl)quinoxaline-6-carboxamide
CID 110690558
N-(3-chloro-4-methoxyphenyl)-4-propan-2-ylbenzamide
CID 1406499
3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
CID 2976183
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
N-(3-chloro-4-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18150443
N-(3,4-dichlorophenyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 2223889
3,4-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776412
N-(3-chloro-4-methoxyphenyl)-4-ethylbenzamide
CID 2540642

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide (CID 795184) is N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide is COc1ccc(NC(=O)c2ccc(OC)c(OC)c2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide?
The InChIKey is FUDNAYXLBLVEOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO4/c1-20-13-7-5-11(9-12(13)17)18-16(19)10-4-6-14(21-2)15(8-10)22-3/h4-9H,1-3H3,(H,18,19).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide?
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide has a molecular weight of 321.76 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide is sourced from PubChem (CID 795184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).