4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide

C21H18ClN3O2 — CID 109091921

IUPAC4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccccc3Cl)ccn2)cc1C
InChIInChI=1S/C21H18ClN3O2/c1-13-7-8-16(11-14(13)2)24-21(27)19-12-15(9-10-23-19)20(26)25-18-6-4-3-5-17(18)22/h3-12H,1-2H3,(H,24,27)(H,25,26)
InChIKeyGKOOTHFHFWTMDX-UHFFFAOYSA-N
MW379.85 g/mol
LogP4.86
Rot. Bonds4

About 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide

4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109091921) has the molecular formula C21H18ClN3O2 and a molecular weight of 379.85 g/mol. Its IUPAC name is 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109091921
Molecular FormulaC21H18ClN3O2
Molecular Weight379.85 g/mol
Exact Mass379.11
IUPAC Name4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1ccc(NC(=O)c2cc(C(=O)Nc3ccccc3Cl)ccn2)cc1C
InChIInChI=1S/C21H18ClN3O2/c1-13-7-8-16(11-14(13)2)24-21(27)19-12-15(9-10-23-19)20(26)25-18-6-4-3-5-17(18)22/h3-12H,1-2H3,(H,24,27)(H,25,26)
InChIKeyGKOOTHFHFWTMDX-UHFFFAOYSA-N
XLogP4.86
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.85
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(3,4-dimethylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109091879
2-N-(2-chlorophenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092468
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
2-N-(3-chlorophenyl)-4-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091882
2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109091918
2-N-(2-chlorophenyl)-4-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092798
2-N-(3-chloro-4-fluorophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091011
2-N-(3-chloro-4-methylphenyl)-4-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091966
2-N-(2-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092591
2-N-(3-chloro-4-methylphenyl)-4-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091288
2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085561
N-(3,4-dimethylphenyl)-4-(2-methylanilino)pyridine-2-carboxamide
CID 109219004

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide (CID 109091921) is 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide is Cc1ccc(NC(=O)c2cc(C(=O)Nc3ccccc3Cl)ccn2)cc1C.
What is the InChIKey of 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is GKOOTHFHFWTMDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O2/c1-13-7-8-16(11-14(13)2)24-21(27)19-12-15(9-10-23-19)20(26)25-18-6-4-3-5-17(18)22/h3-12H,1-2H3,(H,24,27)(H,25,26).
What are the key properties of 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide?
4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 379.85 g/mol, XLogP of 4.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).