5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide

C18H21N3O4 — CID 109101267

IUPAC5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
SMILESCCCNC(=O)c1cncc(C(=O)Nc2ccc(OC)cc2OC)c1
InChIInChI=1S/C18H21N3O4/c1-4-7-20-17(22)12-8-13(11-19-10-12)18(23)21-15-6-5-14(24-2)9-16(15)25-3/h5-6,8-11H,4,7H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyNIXLKFNQSWWMDG-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.49
Rot. Bonds7

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

5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide (PubChem CID 109101267) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
PubChem CID109101267
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
SMILESCCCNC(=O)c1cncc(C(=O)Nc2ccc(OC)cc2OC)c1
InChIInChI=1S/C18H21N3O4/c1-4-7-20-17(22)12-8-13(11-19-10-12)18(23)21-15-6-5-14(24-2)9-16(15)25-3/h5-6,8-11H,4,7H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyNIXLKFNQSWWMDG-UHFFFAOYSA-N
XLogP2.49
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109101658
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245476
3-N-(2,4-dimethoxyphenyl)-1-N-(2-methoxyethyl)benzene-1,3-dicarboxamide
CID 109052609
N'-(2,4-dimethoxyphenyl)-N-propyloxamide
CID 44995967
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
3-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 47231705
4-N-(2,4-dimethoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045814
3-N-(2,5-dimethoxyphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106788
2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109079502
3-N-butyl-5-N-(4-chloro-2,5-dimethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109102088
5-(2,4-dimethoxyanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243459
3-N-propyl-5-N-(2,3,4-trifluorophenyl)pyridine-3,5-dicarboxamide
CID 109101322

Frequently Asked Questions

What is the IUPAC name of 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide (CID 109101267) is 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide is CCCNC(=O)c1cncc(C(=O)Nc2ccc(OC)cc2OC)c1.
What is the InChIKey of 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide?
The InChIKey is NIXLKFNQSWWMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-4-7-20-17(22)12-8-13(11-19-10-12)18(23)21-15-6-5-14(24-2)9-16(15)25-3/h5-6,8-11H,4,7H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide?
5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide has a molecular weight of 343.38 g/mol, XLogP of 2.49, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 109101267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).