4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide

C20H16ClN3O2 — CID 109086644

IUPAC4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
SMILESO=C(NCc1ccccc1Cl)c1ccnc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C20H16ClN3O2/c21-17-9-5-4-6-15(17)13-23-19(25)14-10-11-22-18(12-14)20(26)24-16-7-2-1-3-8-16/h1-12H,13H2,(H,23,25)(H,24,26)
InChIKeyZRIRBJXICJWAKM-UHFFFAOYSA-N
MW365.82 g/mol
LogP3.92
Rot. Bonds5

About 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide

4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109086644) has the molecular formula C20H16ClN3O2 and a molecular weight of 365.82 g/mol. Its IUPAC name is 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
PubChem CID109086644
Molecular FormulaC20H16ClN3O2
Molecular Weight365.82 g/mol
Exact Mass365.09
IUPAC Name4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
SMILESO=C(NCc1ccccc1Cl)c1ccnc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C20H16ClN3O2/c21-17-9-5-4-6-15(17)13-23-19(25)14-10-11-22-18(12-14)20(26)24-16-7-2-1-3-8-16/h1-12H,13H2,(H,23,25)(H,24,26)
InChIKeyZRIRBJXICJWAKM-UHFFFAOYSA-N
XLogP3.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[(2-chlorophenyl)methyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109086683
2-N-[(2-chlorophenyl)methyl]-4-N-[(2-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086329
4-N-[(2-chlorophenyl)methyl]-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109086668
4-N-[(2-chlorophenyl)methyl]-2-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082657
2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085561
N-[(2-chlorophenyl)methyl]-2-[(2-chlorophenyl)methylamino]pyridine-4-carboxamide
CID 109170717
2-(4-acetamidoanilino)-N-[(2-chlorophenyl)methyl]pyridine-4-carboxamide
CID 109170770
4-N-[(2-fluorophenyl)methyl]-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109086373
4-N-[(4-methoxyphenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide
CID 109086890
N-[(2-chlorophenyl)methyl]-4-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109081046
2-N-(3-chlorophenyl)-4-N-[(2-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086818
4-N-benzyl-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109085321

Frequently Asked Questions

What is the IUPAC name of 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide (CID 109086644) is 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide is O=C(NCc1ccccc1Cl)c1ccnc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide?
The InChIKey is ZRIRBJXICJWAKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O2/c21-17-9-5-4-6-15(17)13-23-19(25)14-10-11-22-18(12-14)20(26)24-16-7-2-1-3-8-16/h1-12H,13H2,(H,23,25)(H,24,26).
What are the key properties of 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide?
4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide has a molecular weight of 365.82 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[(2-chlorophenyl)methyl]-2-N-phenylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109086644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).