5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide

C21H18ClN3O3 — CID 109105759

IUPAC5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C21H18ClN3O3/c1-28-19-9-5-2-6-14(19)13-24-20(26)15-10-16(12-23-11-15)21(27)25-18-8-4-3-7-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27)
InChIKeyWGXIUUADZWADKF-UHFFFAOYSA-N
MW395.85 g/mol
LogP3.93
Rot. Bonds6

About 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide

5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide (PubChem CID 109105759) has the molecular formula C21H18ClN3O3 and a molecular weight of 395.85 g/mol. Its IUPAC name is 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
PubChem CID109105759
Molecular FormulaC21H18ClN3O3
Molecular Weight395.85 g/mol
Exact Mass395.10
IUPAC Name5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
SMILESCOc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C21H18ClN3O3/c1-28-19-9-5-2-6-14(19)13-24-20(26)15-10-16(12-23-11-15)21(27)25-18-8-4-3-7-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27)
InChIKeyWGXIUUADZWADKF-UHFFFAOYSA-N
XLogP3.93
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.85
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-N-(2-methoxyphenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105762
4-N-(2-chlorophenyl)-1-N-[(2-methoxyphenyl)methyl]benzene-1,4-dicarboxamide
CID 109047395
6-N-(2-chlorophenyl)-2-N-[(2-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097991
3-N-benzyl-5-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109105048
5-N-(3-fluorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105765
5-N-(2-chlorophenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101245
N-[(2-methoxyphenyl)methyl]pyrimidine-5-carboxamide
CID 110466860
3-N-[(2-methoxyphenyl)methyl]-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109105740
N-(2-chlorophenyl)-5-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109244385
5-(2-chloro-4,6-dimethylanilino)-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109234228
5-N-(2-chlorophenyl)-3-N-(furan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109104909
3-chloro-4-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 95970560

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide (CID 109105759) is 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide is COc1ccccc1CNC(=O)c1cncc(C(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
The InChIKey is WGXIUUADZWADKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O3/c1-28-19-9-5-2-6-14(19)13-24-20(26)15-10-16(12-23-11-15)21(27)25-18-8-4-3-7-17(18)22/h2-12H,13H2,1H3,(H,24,26)(H,25,27).
What are the key properties of 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide?
5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide has a molecular weight of 395.85 g/mol, XLogP of 3.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-chlorophenyl)-3-N-[(2-methoxyphenyl)methyl]pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).