2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide

C15H13Cl2NO2 — CID 106501484

IUPAC2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccccc1Cl)C(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C15H13Cl2NO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(19)6-7-14(12)17/h2-8,19H,9H2,1H3
InChIKeyJVNWFDBJYICFTK-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.97
Rot. Bonds3

About 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide

2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide (PubChem CID 106501484) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide.

Molecular Properties

Compound Name2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide
PubChem CID106501484
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccccc1Cl)C(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C15H13Cl2NO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(19)6-7-14(12)17/h2-8,19H,9H2,1H3
InChIKeyJVNWFDBJYICFTK-UHFFFAOYSA-N
XLogP3.97
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methyl-methylcarbamoyl]benzoic acid
CID 43399794
N-[(2-chlorophenyl)methyl]-5-fluoro-2-hydroxy-N-methylbenzamide
CID 79532591
2-chloro-N-[(2-chlorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 60628317
N-[[2-(aminomethyl)phenyl]methyl]-2,5-dihydroxy-N-methylbenzamide
CID 107721274
5-bromo-2-chloro-N-[(2-chlorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 62000635
2-chloro-N-(cyanomethyl)-5-hydroxy-N-methylbenzamide
CID 106500987
N-(3-aminopropyl)-2-chloro-5-hydroxy-N-methylbenzamide
CID 106499987
2-chloro-5-hydroxy-N-methyl-N-(2-methylprop-2-enyl)benzamide
CID 106502176
1-[(2-chlorophenyl)methyl]-1-methylurea
CID 60703173
N-[(2-chlorophenyl)methyl]-N-methylthiophene-3-carboxamide
CID 78802983
5-amino-N-[(2-chlorophenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61117952
4-amino-N-[(2-chlorophenyl)methyl]-N,6-dimethylpyridine-3-carboxamide
CID 81240859

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide?
The IUPAC name of 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide (CID 106501484) is 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide.
What is the SMILES notation for 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide?
The canonical SMILES for 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide is CN(Cc1ccccc1Cl)C(=O)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide?
The InChIKey is JVNWFDBJYICFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-18(9-10-4-2-3-5-13(10)16)15(20)12-8-11(19)6-7-14(12)17/h2-8,19H,9H2,1H3.
What are the key properties of 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide?
2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide has a molecular weight of 310.18 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(2-chlorophenyl)methyl]-5-hydroxy-N-methylbenzamide is sourced from PubChem (CID 106501484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).