4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide

C15H13Cl2NO2 — CID 47449773

IUPAC4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)NCc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-20-14-8-12(17)5-6-13(14)15(19)18-9-10-3-2-4-11(16)7-10/h2-8H,9H2,1H3,(H,18,19)
InChIKeyVSVMDYWBNZATCP-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.93
Rot. Bonds4

About 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide

4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide (PubChem CID 47449773) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide.

Molecular Properties

Compound Name4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide
PubChem CID47449773
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)NCc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-20-14-8-12(17)5-6-13(14)15(19)18-9-10-3-2-4-11(16)7-10/h2-8H,9H2,1H3,(H,18,19)
InChIKeyVSVMDYWBNZATCP-UHFFFAOYSA-N
XLogP3.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-chloro-N-[(3-chlorophenyl)methyl]-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-[(3-aminophenyl)methyl]-4-chloro-2-methoxybenzamide
CID 62500246
4-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 47449992
1-N,3-N-bis[(3-chlorophenyl)methyl]-4-methoxybenzene-1,3-dicarboxamide
CID 71608078
4-chloro-2-methoxy-N-[(4-propan-2-ylphenyl)methyl]benzamide
CID 71822149
5-chloro-N-[[3-(chloromethyl)phenyl]methyl]-2-methoxybenzamide
CID 114302427
5-chloro-N-[[3-(hydroxymethyl)phenyl]methyl]-2-methoxybenzamide
CID 63311043
N-[(3-chlorophenyl)methyl]-3,4,5-trimethoxybenzamide
CID 2681202
2-amino-4-chloro-N-[(3-chlorophenyl)methyl]benzamide
CID 61111340
N-[(3-bromo-4,5-dimethoxyphenyl)methyl]-4-chloro-2-methoxybenzamide
CID 60611767
5-chloro-N-[(3-chlorophenyl)methyl]-2-fluorobenzamide
CID 9079628
N-[(3-chlorophenyl)methyl]-2-(difluoromethoxy)-3-methoxybenzamide
CID 51158712
N-[(3-chlorophenyl)methyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 710725

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide?
The IUPAC name of 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide (CID 47449773) is 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide.
What is the SMILES notation for 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide?
The canonical SMILES for 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide is COc1cc(Cl)ccc1C(=O)NCc1cccc(Cl)c1.
What is the InChIKey of 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide?
The InChIKey is VSVMDYWBNZATCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-20-14-8-12(17)5-6-13(14)15(19)18-9-10-3-2-4-11(16)7-10/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide?
4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide has a molecular weight of 310.18 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide is sourced from PubChem (CID 47449773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).