2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide

C19H15Cl2N3O — CID 113012299

IUPAC2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccc(Cl)cc2)nc1)c1ccccc1Cl
InChIInChI=1S/C19H15Cl2N3O/c20-14-7-5-13(6-8-14)11-22-18-10-9-15(12-23-18)24-19(25)16-3-1-2-4-17(16)21/h1-10,12H,11H2,(H,22,23)(H,24,25)
InChIKeyYPBYSFITLQNZJN-UHFFFAOYSA-N
MW372.26 g/mol
LogP5.25
Rot. Bonds5

About 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide

2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide (PubChem CID 113012299) has the molecular formula C19H15Cl2N3O and a molecular weight of 372.26 g/mol. Its IUPAC name is 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide
PubChem CID113012299
Molecular FormulaC19H15Cl2N3O
Molecular Weight372.26 g/mol
Exact Mass371.06
IUPAC Name2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccc(Cl)cc2)nc1)c1ccccc1Cl
InChIInChI=1S/C19H15Cl2N3O/c20-14-7-5-13(6-8-14)11-22-18-10-9-15(12-23-18)24-19(25)16-3-1-2-4-17(16)21/h1-10,12H,11H2,(H,22,23)(H,24,25)
InChIKeyYPBYSFITLQNZJN-UHFFFAOYSA-N
XLogP5.25
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.26
LogP ≤ 55.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-2-methylbenzamide
CID 113012276
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-2-phenylacetamide
CID 113012292
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]furan-2-carboxamide
CID 113012273
2-fluoro-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011760
methyl N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]carbamate
CID 113012316
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]-3-fluorobenzamide
CID 113012280
4-chloro-N-[6-(pyridin-4-ylmethylamino)-3-pyridinyl]benzamide
CID 113012926
2-chloro-N-[6-(3-hydroxypropylamino)-3-pyridinyl]benzamide
CID 28901836
2-chloro-6-fluoro-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011791
4-chloro-N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]benzamide
CID 113027275
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]butanamide
CID 113012264
N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
CID 1449171

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide?
The IUPAC name of 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide (CID 113012299) is 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide.
What is the SMILES notation for 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide?
The canonical SMILES for 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide is O=C(Nc1ccc(NCc2ccc(Cl)cc2)nc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide?
The InChIKey is YPBYSFITLQNZJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O/c20-14-7-5-13(6-8-14)11-22-18-10-9-15(12-23-18)24-19(25)16-3-1-2-4-17(16)21/h1-10,12H,11H2,(H,22,23)(H,24,25).
What are the key properties of 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide?
2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide has a molecular weight of 372.26 g/mol, XLogP of 5.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]benzamide is sourced from PubChem (CID 113012299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).