N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide

C22H23N3O4 — CID 109245476

IUPACN-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2cncc(C(=O)Nc3ccc(OC)cc3OC)c2)cc1
InChIInChI=1S/C22H23N3O4/c1-4-29-18-7-5-16(6-8-18)24-17-11-15(13-23-14-17)22(26)25-20-10-9-19(27-2)12-21(20)28-3/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyUGPRNUAJYZVHOB-UHFFFAOYSA-N
MW393.44 g/mol
LogP4.49
Rot. Bonds8

About N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide

N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide (PubChem CID 109245476) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
PubChem CID109245476
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC NameN-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2cncc(C(=O)Nc3ccc(OC)cc3OC)c2)cc1
InChIInChI=1S/C22H23N3O4/c1-4-29-18-7-5-16(6-8-18)24-17-11-15(13-23-14-17)22(26)25-20-10-9-19(27-2)12-21(20)28-3/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyUGPRNUAJYZVHOB-UHFFFAOYSA-N
XLogP4.49
TPSA81.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-ethoxyanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109245293
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2,4-difluorophenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245490
5-(2,4-dimethoxyanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243459
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
CID 109245646
5-(3-chloro-4-methoxyanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109245025
5-N-(2,4-dimethoxyphenyl)-3-N-propylpyridine-3,5-dicarboxamide
CID 109101267
N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109244724
5-(cyclohexylamino)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109226939
5-(cycloheptylamino)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109239634
5-(2,4-dimethoxyanilino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109243833
N-(2,4-dichlorophenyl)-5-(4-methoxyanilino)pyridine-3-carboxamide
CID 109245369

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide (CID 109245476) is N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide is CCOc1ccc(Nc2cncc(C(=O)Nc3ccc(OC)cc3OC)c2)cc1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The InChIKey is UGPRNUAJYZVHOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-4-29-18-7-5-16(6-8-18)24-17-11-15(13-23-14-17)22(26)25-20-10-9-19(27-2)12-21(20)28-3/h5-14,24H,4H2,1-3H3,(H,25,26).
What are the key properties of N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide has a molecular weight of 393.44 g/mol, XLogP of 4.49, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109245476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).