2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide

C19H23N3O4 — CID 109079502

IUPAC2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCCCCNC(=O)c1cc(C(=O)Nc2ccc(OC)cc2OC)ccn1
InChIInChI=1S/C19H23N3O4/c1-4-5-9-21-19(24)16-11-13(8-10-20-16)18(23)22-15-7-6-14(25-2)12-17(15)26-3/h6-8,10-12H,4-5,9H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyNIWWFBUORABVMX-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.88
Rot. Bonds8

About 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide

2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109079502) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109079502
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC Name2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCCCCNC(=O)c1cc(C(=O)Nc2ccc(OC)cc2OC)ccn1
InChIInChI=1S/C19H23N3O4/c1-4-5-9-21-19(24)16-11-13(8-10-20-16)18(23)22-15-7-6-14(25-2)12-17(15)26-3/h6-8,10-12H,4-5,9H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyNIWWFBUORABVMX-UHFFFAOYSA-N
XLogP2.88
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-N-(2,4-dimethoxyphenyl)-2-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078342
2-N-butyl-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109079380
2-N-butyl-4-N-(2-methoxyethyl)pyridine-2,4-dicarboxamide
CID 109079379
N-(2,4-dimethoxyphenyl)-2-methoxypyridine-4-carboxamide
CID 84580517
4-N-(2,4-dimethoxyphenyl)-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083355
methyl N-[[4-[(2,4-dimethoxyphenyl)carbamoyl]-2-pyridinyl]methyl]carbamate
CID 112521455
4-N-(2,4-dimethoxyphenyl)-2-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,4-dicarboxamide
CID 109093166
4-N-[(4-methoxyphenyl)methyl]-2-N-pentylpyridine-2,4-dicarboxamide
CID 109086884
methyl 2-[[2-(pentylcarbamoyl)pyridine-4-carbonyl]amino]benzoate
CID 109089904
N-(2,4-dimethoxyphenyl)-4-methylpyridine-2-carboxamide
CID 110860588
5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101267
2-N-butyl-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109079504

Frequently Asked Questions

What is the IUPAC name of 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide (CID 109079502) is 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide is CCCCNC(=O)c1cc(C(=O)Nc2ccc(OC)cc2OC)ccn1.
What is the InChIKey of 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is NIWWFBUORABVMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-4-5-9-21-19(24)16-11-13(8-10-20-16)18(23)22-15-7-6-14(25-2)12-17(15)26-3/h6-8,10-12H,4-5,9H2,1-3H3,(H,21,24)(H,22,23).
What are the key properties of 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide?
2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 357.41 g/mol, XLogP of 2.88, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butyl-4-N-(2,4-dimethoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109079502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).