N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide

C14H12Cl2N2O — CID 107095714

IUPACN-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide
SMILESCc1c(Cl)cccc1C(=O)Nc1cc(Cl)ccc1N
InChIInChI=1S/C14H12Cl2N2O/c1-8-10(3-2-4-11(8)16)14(19)18-13-7-9(15)5-6-12(13)17/h2-7H,17H2,1H3,(H,18,19)
InChIKeyBHEIRRAOEDCBOO-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.14
Rot. Bonds2

About N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide

N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide (PubChem CID 107095714) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide
PubChem CID107095714
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC NameN-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide
SMILESCc1c(Cl)cccc1C(=O)Nc1cc(Cl)ccc1N
InChIInChI=1S/C14H12Cl2N2O/c1-8-10(3-2-4-11(8)16)14(19)18-13-7-9(15)5-6-12(13)17/h2-7H,17H2,1H3,(H,18,19)
InChIKeyBHEIRRAOEDCBOO-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'}

Analyze N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide 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-(2-amino-5-fluorophenyl)-3-chloro-2-methylbenzamide
CID 110484078
N-(2-amino-4,5-dimethylphenyl)-3-chloro-2-methylbenzamide
CID 107095769
N-(2-amino-5-chlorophenyl)-5-chloro-2-methylbenzamide
CID 82880207
N-(2-amino-5-chlorophenyl)-2,5-dimethylbenzamide
CID 18072338
3-amino-N-(4-chloro-2-iodophenyl)-2-methylbenzamide
CID 107624186
N-(2-amino-5-chlorophenyl)-3-bromo-2-fluorobenzamide
CID 107948709
N-(2-amino-5-chlorophenyl)-5-bromo-2-methylbenzamide
CID 65306711
2-amino-3-chloro-N-(4-chloro-2-methylphenyl)benzamide
CID 82546494
N-(3-aminophenyl)-3-chloro-2-methylbenzamide
CID 110484087
3-amino-2-methyl-N-(2,4,5-trichlorophenyl)benzamide
CID 23464406
N-(2-aminophenyl)-2-chlorobenzamide
CID 684680
3-chloro-N-(5-iodo-2-methylphenyl)-2-methylbenzamide
CID 114257023

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide (CID 107095714) is N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide is Cc1c(Cl)cccc1C(=O)Nc1cc(Cl)ccc1N.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide?
The InChIKey is BHEIRRAOEDCBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-8-10(3-2-4-11(8)16)14(19)18-13-7-9(15)5-6-12(13)17/h2-7H,17H2,1H3,(H,18,19).
What are the key properties of N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide?
N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide 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 N-(2-amino-5-chlorophenyl)-3-chloro-2-methylbenzamide is sourced from PubChem (CID 107095714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).