5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide

C18H19N3O4 — CID 109101658

IUPAC5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
SMILESCOc1ccc(NC(=O)c2cncc(C(=O)NC3CC3)c2)c(OC)c1
InChIInChI=1S/C18H19N3O4/c1-24-14-5-6-15(16(8-14)25-2)21-18(23)12-7-11(9-19-10-12)17(22)20-13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyXNWNULMOLCVABP-UHFFFAOYSA-N
MW341.37 g/mol
LogP2.24
Rot. Bonds6

About 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide

5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109101658) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
PubChem CID109101658
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC Name5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
SMILESCOc1ccc(NC(=O)c2cncc(C(=O)NC3CC3)c2)c(OC)c1
InChIInChI=1S/C18H19N3O4/c1-24-14-5-6-15(16(8-14)25-2)21-18(23)12-7-11(9-19-10-12)17(22)20-13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyXNWNULMOLCVABP-UHFFFAOYSA-N
XLogP2.24
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109043393
5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101267
3-N-cyclohexyl-1-N-(2,4-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109052232
5-(cycloheptylamino)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109239634
5-(cyclohexylamino)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109226939
N-cyclopentyl-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109226008
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2,4-dimethoxyphenyl)-5-(2-ethylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107460
3-N-cycloheptyl-1-N-(2,5-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109056122
3-amino-N-cyclopropyl-4-(2,4-dimethoxyanilino)benzamide
CID 100630364
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245476

Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide (CID 109101658) is 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide is COc1ccc(NC(=O)c2cncc(C(=O)NC3CC3)c2)c(OC)c1.
What is the InChIKey of 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is XNWNULMOLCVABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-24-14-5-6-15(16(8-14)25-2)21-18(23)12-7-11(9-19-10-12)17(22)20-13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide?
5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 341.37 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109101658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).