2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide

C18H13Cl2N3O — CID 59673398

IUPAC2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide
SMILESNc1cc(-c2ncccc2Cl)ccc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C18H13Cl2N3O/c19-12-4-6-13(7-5-12)23-18(24)14-8-3-11(10-16(14)21)17-15(20)2-1-9-22-17/h1-10H,21H2,(H,23,24)
InChIKeyIOIPJAZFSXAIMW-UHFFFAOYSA-N
MW358.23 g/mol
LogP4.89
Rot. Bonds3

About 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide

2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide (PubChem CID 59673398) has the molecular formula C18H13Cl2N3O and a molecular weight of 358.23 g/mol. Its IUPAC name is 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide
PubChem CID59673398
Molecular FormulaC18H13Cl2N3O
Molecular Weight358.23 g/mol
Exact Mass357.04
IUPAC Name2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide
SMILESNc1cc(-c2ncccc2Cl)ccc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C18H13Cl2N3O/c19-12-4-6-13(7-5-12)23-18(24)14-8-3-11(10-16(14)21)17-15(20)2-1-9-22-17/h1-10H,21H2,(H,23,24)
InChIKeyIOIPJAZFSXAIMW-UHFFFAOYSA-N
XLogP4.89
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.23
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-4-(3-chloro-2-pyridinyl)-N-[4-(diethylamino)phenyl]benzamide
CID 59673340
4-(3-chloro-2-pyridinyl)-2-fluoro-N-(4-methoxyphenyl)benzamide
CID 11337240
4-(3-chloro-2-pyridinyl)-2-fluoro-N-(4-nitrophenyl)benzamide
CID 59672710
4-(3-chloro-2-pyridinyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-fluorobenzamide
CID 11407730
4-(3-chloro-2-pyridinyl)-N-(6-chloro-3-pyridinyl)-2-(methylamino)benzamide
CID 59672910
4-(3-chloro-2-pyridinyl)-N-(4-phenylphenyl)benzamide
CID 11234504
4-(3-chloro-2-pyridinyl)-N-(3-cyanophenyl)-2-fluorobenzamide
CID 11484943
2-chloro-4-(3-chloro-2-pyridinyl)benzoic acid
CID 68944876
4-(3-chloro-2-pyridinyl)-N-(4-ethyl-2-pyridinyl)-2-fluorobenzamide
CID 11451124
N-tert-butyl-4-(3-chloro-2-pyridinyl)-2-fluorobenzamide
CID 11381243
4-(3-chloro-2-pyridinyl)-N-[4-(3-fluorophenyl)phenyl]benzamide
CID 86100465
2-amino-5-chloro-N-(4-chlorophenyl)benzamide
CID 4186019

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide?
The IUPAC name of 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide (CID 59673398) is 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide.
What is the SMILES notation for 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide?
The canonical SMILES for 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide is Nc1cc(-c2ncccc2Cl)ccc1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide?
The InChIKey is IOIPJAZFSXAIMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O/c19-12-4-6-13(7-5-12)23-18(24)14-8-3-11(10-16(14)21)17-15(20)2-1-9-22-17/h1-10H,21H2,(H,23,24).
What are the key properties of 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide?
2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide has a molecular weight of 358.23 g/mol, XLogP of 4.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-chlorophenyl)-4-(3-chloro-2-pyridinyl)benzamide is sourced from PubChem (CID 59673398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).