N-(2-amino-5-chlorophenyl)-4-chlorobenzamide

C13H10Cl2N2O — CID 16771665

IUPACN-(2-amino-5-chlorophenyl)-4-chlorobenzamide
SMILESNc1ccc(Cl)cc1NC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2N2O/c14-9-3-1-8(2-4-9)13(18)17-12-7-10(15)5-6-11(12)16/h1-7H,16H2,(H,17,18)
InChIKeyFHDNCOOEQRMUDY-UHFFFAOYSA-N
MW281.14 g/mol
LogP3.83
Rot. Bonds2

About N-(2-amino-5-chlorophenyl)-4-chlorobenzamide

N-(2-amino-5-chlorophenyl)-4-chlorobenzamide (PubChem CID 16771665) has the molecular formula C13H10Cl2N2O and a molecular weight of 281.14 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-4-chlorobenzamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-4-chlorobenzamide
PubChem CID16771665
Molecular FormulaC13H10Cl2N2O
Molecular Weight281.14 g/mol
Exact Mass280.02
IUPAC NameN-(2-amino-5-chlorophenyl)-4-chlorobenzamide
SMILESNc1ccc(Cl)cc1NC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2N2O/c14-9-3-1-8(2-4-9)13(18)17-12-7-10(15)5-6-11(12)16/h1-7H,16H2,(H,17,18)
InChIKeyFHDNCOOEQRMUDY-UHFFFAOYSA-N
XLogP3.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.14
LogP ≤ 53.83
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

N-(2-amino-5-chlorophenyl)-4-hydroxybenzamide
CID 18070438
N-(2-amino-5-chlorophenyl)-3-fluoro-4-methylbenzamide
CID 16771232
N-(2-amino-5-chlorophenyl)-5-bromothiophene-3-carboxamide
CID 107959269
N-(2-amino-5-chlorophenyl)-5-chloro-2-methylbenzamide
CID 82880207
N-(4-amino-2,5-dimethylphenyl)-4-chlorobenzamide
CID 103144495
N-(2-amino-4-chlorophenyl)-4-tert-butylbenzamide
CID 16777469
4-amino-N-(2-bromo-5-chlorophenyl)-3-methylbenzamide
CID 81262936
N-[2-[(2-aminoacetyl)amino]-4-chlorophenyl]-4-chlorobenzamide
CID 39192788
N-(4-amino-6-chloro-9,10-dioxoanthracen-1-yl)-4-chlorobenzamide
CID 163650407
N-(5-chloro-2-fluorophenyl)-4-fluorobenzamide
CID 2664585
N-(4-amino-2-hydroxyphenyl)-4-chlorobenzamide
CID 3264738
N-(2-amino-5-chlorophenyl)-2,5-dimethylbenzamide
CID 18072338

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-4-chlorobenzamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-4-chlorobenzamide (CID 16771665) is N-(2-amino-5-chlorophenyl)-4-chlorobenzamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-4-chlorobenzamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-4-chlorobenzamide is Nc1ccc(Cl)cc1NC(=O)c1ccc(Cl)cc1.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-4-chlorobenzamide?
The InChIKey is FHDNCOOEQRMUDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O/c14-9-3-1-8(2-4-9)13(18)17-12-7-10(15)5-6-11(12)16/h1-7H,16H2,(H,17,18).
What are the key properties of N-(2-amino-5-chlorophenyl)-4-chlorobenzamide?
N-(2-amino-5-chlorophenyl)-4-chlorobenzamide has a molecular weight of 281.14 g/mol, XLogP of 3.83, 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)-4-chlorobenzamide is sourced from PubChem (CID 16771665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).