2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide

C14H10Cl3NO — CID 4548334

IUPAC2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide
SMILESCc1cccc(Cl)c1NC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H10Cl3NO/c1-8-4-2-7-11(17)13(8)18-14(19)12-9(15)5-3-6-10(12)16/h2-7H,1H3,(H,18,19)
InChIKeyDLNYXUBDINNKJX-UHFFFAOYSA-N
MW314.60 g/mol
LogP5.21
Rot. Bonds2

About 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide

2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide (PubChem CID 4548334) has the molecular formula C14H10Cl3NO and a molecular weight of 314.60 g/mol. Its IUPAC name is 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide
PubChem CID4548334
Molecular FormulaC14H10Cl3NO
Molecular Weight314.60 g/mol
Exact Mass312.98
IUPAC Name2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide
SMILESCc1cccc(Cl)c1NC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H10Cl3NO/c1-8-4-2-7-11(17)13(8)18-14(19)12-9(15)5-3-6-10(12)16/h2-7H,1H3,(H,18,19)
InChIKeyDLNYXUBDINNKJX-UHFFFAOYSA-N
XLogP5.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.60
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-chloro-6-methylphenyl)thiophene-2-carboxamide
CID 66254505
4-tert-butyl-N-(2-chloro-6-methylphenyl)benzamide
CID 721211
6-[(2-chloro-6-methylphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 66254491
3-[(2-chloro-6-methylphenyl)carbamoyl]benzoic acid
CID 66254685
N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
CID 103865613
N-(2-chloro-6-methylphenyl)-3-hydroxy-4-methylbenzamide
CID 66254574
N-(2-chloro-6-methylphenyl)pyrimidine-4-carboxamide
CID 141229709
5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide
CID 66254946
2-amino-6-chloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 63659820
2-chloro-6-methyl-N-pyridin-4-ylbenzamide
CID 59618146
5-bromo-N-(2-chloro-6-methylphenyl)pyridine-2-carboxamide
CID 66255147
4-bromo-3-chloro-N-(2-chloro-6-methylphenyl)benzamide
CID 81002737

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide (CID 4548334) is 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide is Cc1cccc(Cl)c1NC(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide?
The InChIKey is DLNYXUBDINNKJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NO/c1-8-4-2-7-11(17)13(8)18-14(19)12-9(15)5-3-6-10(12)16/h2-7H,1H3,(H,18,19).
What are the key properties of 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide?
2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide has a molecular weight of 314.60 g/mol, XLogP of 5.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(2-chloro-6-methylphenyl)benzamide is sourced from PubChem (CID 4548334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).