2-amino-N-(3-chlorophenyl)benzamide

C13H11ClN2O — CID 720859

IUPAC2-amino-N-(3-chlorophenyl)benzamide
SMILESNc1ccccc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C13H11ClN2O/c14-9-4-3-5-10(8-9)16-13(17)11-6-1-2-7-12(11)15/h1-8H,15H2,(H,16,17)
InChIKeyPODFNAVRZPMCEM-UHFFFAOYSA-N
MW246.70 g/mol
LogP3.17
Rot. Bonds2

About 2-amino-N-(3-chlorophenyl)benzamide

2-amino-N-(3-chlorophenyl)benzamide (PubChem CID 720859) has the molecular formula C13H11ClN2O and a molecular weight of 246.70 g/mol. Its IUPAC name is 2-amino-N-(3-chlorophenyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(3-chlorophenyl)benzamide
PubChem CID720859
Molecular FormulaC13H11ClN2O
Molecular Weight246.70 g/mol
Exact Mass246.06
IUPAC Name2-amino-N-(3-chlorophenyl)benzamide
SMILESNc1ccccc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C13H11ClN2O/c14-9-4-3-5-10(8-9)16-13(17)11-6-1-2-7-12(11)15/h1-8H,15H2,(H,16,17)
InChIKeyPODFNAVRZPMCEM-UHFFFAOYSA-N
XLogP3.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.70
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-chlorophenyl)benzamide?
The IUPAC name of 2-amino-N-(3-chlorophenyl)benzamide (CID 720859) is 2-amino-N-(3-chlorophenyl)benzamide.
What is the SMILES notation for 2-amino-N-(3-chlorophenyl)benzamide?
The canonical SMILES for 2-amino-N-(3-chlorophenyl)benzamide is Nc1ccccc1C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of 2-amino-N-(3-chlorophenyl)benzamide?
The InChIKey is PODFNAVRZPMCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O/c14-9-4-3-5-10(8-9)16-13(17)11-6-1-2-7-12(11)15/h1-8H,15H2,(H,16,17).
What are the key properties of 2-amino-N-(3-chlorophenyl)benzamide?
2-amino-N-(3-chlorophenyl)benzamide has a molecular weight of 246.70 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-chlorophenyl)benzamide is sourced from PubChem (CID 720859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).