2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide

C14H12Cl2N2O — CID 28967454

IUPAC2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2N)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2O/c1-8-2-5-13(11(16)6-8)18-14(19)10-7-9(15)3-4-12(10)17/h2-7H,17H2,1H3,(H,18,19)
InChIKeyOTRXZHZMBCAYHK-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.14
Rot. Bonds2

About 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide

2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide (PubChem CID 28967454) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide
PubChem CID28967454
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2N)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2O/c1-8-2-5-13(11(16)6-8)18-14(19)10-7-9(15)3-4-12(10)17/h2-7H,17H2,1H3,(H,18,19)
InChIKeyOTRXZHZMBCAYHK-UHFFFAOYSA-N
XLogP4.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(4-bromo-2-chlorophenyl)-5-methylbenzamide
CID 62509847
2-amino-N-(2-bromo-4-chlorophenyl)-5-methylbenzamide
CID 81262086
2-amino-N-(2,4-dichlorophenyl)-5-hydroxybenzamide
CID 107073840
2-amino-5-chloro-N-(2-ethoxy-4-methylphenyl)benzamide
CID 61104309
2-amino-5-chloro-N-(4-methylphenyl)benzamide
CID 6481532
3-amino-5-bromo-N-(2-chloro-4-methylphenyl)-2-methylbenzamide
CID 107872142
N-(2-chloro-4-methylphenyl)-2,5-dimethylbenzamide
CID 2549224
N-(4-amino-2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62515470
4-amino-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967456
2-amino-N-(2-carbamoyl-4-chlorophenyl)-5-chlorobenzamide
CID 172722121
N-(2-amino-4-chlorophenyl)-2-bromo-5-methylbenzamide
CID 81109928
2-amino-N-(5-bromo-2-chlorophenyl)-5-methylbenzamide
CID 62908448

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide?
The IUPAC name of 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide (CID 28967454) is 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide.
What is the SMILES notation for 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide?
The canonical SMILES for 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2cc(Cl)ccc2N)c(Cl)c1.
What is the InChIKey of 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide?
The InChIKey is OTRXZHZMBCAYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-8-2-5-13(11(16)6-8)18-14(19)10-7-9(15)3-4-12(10)17/h2-7H,17H2,1H3,(H,18,19).
What are the key properties of 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide?
2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide has a molecular weight of 295.17 g/mol, XLogP of 4.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide is sourced from PubChem (CID 28967454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).