2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide

C16H15Cl2NO — CID 23019861

IUPAC2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide
SMILESCc1ccc(C)c(CNC(=O)c2cccc(Cl)c2Cl)c1
InChIInChI=1S/C16H15Cl2NO/c1-10-6-7-11(2)12(8-10)9-19-16(20)13-4-3-5-14(17)15(13)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyGVUYAKSUBNNIKD-UHFFFAOYSA-N
MW308.21 g/mol
LogP4.54
Rot. Bonds3

About 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide

2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide (PubChem CID 23019861) has the molecular formula C16H15Cl2NO and a molecular weight of 308.21 g/mol. Its IUPAC name is 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide
PubChem CID23019861
Molecular FormulaC16H15Cl2NO
Molecular Weight308.21 g/mol
Exact Mass307.05
IUPAC Name2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide
SMILESCc1ccc(C)c(CNC(=O)c2cccc(Cl)c2Cl)c1
InChIInChI=1S/C16H15Cl2NO/c1-10-6-7-11(2)12(8-10)9-19-16(20)13-4-3-5-14(17)15(13)18/h3-8H,9H2,1-2H3,(H,19,20)
InChIKeyGVUYAKSUBNNIKD-UHFFFAOYSA-N
XLogP4.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide 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

1-(2,3-dichlorophenyl)-2-(2,5-dimethylphenyl)ethanone
CID 63527350
2,3-dichloro-N-[(5-methyl-2-phenylmethoxyphenyl)methyl]benzamide
CID 23019842
N-[(3-amino-2-methylphenyl)methyl]-2,3-dichlorobenzamide
CID 103110309
N-[(2,5-dimethylphenyl)methyl]acetamide
CID 759326
(2,5-dimethylphenyl)methylcarbamic acid
CID 67570724
2,3-dichloro-N-(2-chloro-4-methylphenyl)benzamide
CID 7926718
2,3-dichloro-N-[(3-chlorophenyl)methyl]benzamide
CID 17071308
2,3-dichloro-N-ethylbenzamide;methane
CID 158305709
N-[(2,5-dimethylphenyl)methyl]pyridine-2-carboxamide
CID 110793358
N-[(2-benzylphenyl)methyl]-2,3-dichlorobenzamide
CID 23019985
1-(2,6-dichlorophenyl)-2-(2,5-dimethylphenyl)ethanone
CID 55224701
N-[(2-hydroxyphenyl)methyl]-2,5-dimethylbenzamide
CID 115598856

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide?
The IUPAC name of 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide (CID 23019861) is 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide.
What is the SMILES notation for 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide?
The canonical SMILES for 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide is Cc1ccc(C)c(CNC(=O)c2cccc(Cl)c2Cl)c1.
What is the InChIKey of 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide?
The InChIKey is GVUYAKSUBNNIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO/c1-10-6-7-11(2)12(8-10)9-19-16(20)13-4-3-5-14(17)15(13)18/h3-8H,9H2,1-2H3,(H,19,20).
What are the key properties of 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide?
2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide has a molecular weight of 308.21 g/mol, XLogP of 4.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[(2,5-dimethylphenyl)methyl]benzamide is sourced from PubChem (CID 23019861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).