5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

C21H21N3O4 — CID 109245108

IUPAC5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Nc2cncc(C(=O)Nc3ccccc3OC)c2)c(OC)c1
InChIInChI=1S/C21H21N3O4/c1-26-16-8-9-18(20(11-16)28-3)23-15-10-14(12-22-13-15)21(25)24-17-6-4-5-7-19(17)27-2/h4-13,23H,1-3H3,(H,24,25)
InChIKeyHNTMHVKAARJQGM-UHFFFAOYSA-N
MW379.42 g/mol
LogP4.10
Rot. Bonds7

About 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide

5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 109245108) has the molecular formula C21H21N3O4 and a molecular weight of 379.42 g/mol. Its IUPAC name is 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID109245108
Molecular FormulaC21H21N3O4
Molecular Weight379.42 g/mol
Exact Mass379.15
IUPAC Name5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Nc2cncc(C(=O)Nc3ccccc3OC)c2)c(OC)c1
InChIInChI=1S/C21H21N3O4/c1-26-16-8-9-18(20(11-16)28-3)23-15-10-14(12-22-13-15)21(25)24-17-6-4-5-7-19(17)27-2/h4-13,23H,1-3H3,(H,24,25)
InChIKeyHNTMHVKAARJQGM-UHFFFAOYSA-N
XLogP4.10
TPSA81.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109244180
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109244383
5-(2,5-dimethoxyanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109244111
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyridine-3-carboxamide
CID 109245646
5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245660
5-(2,3-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109243291
5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109245203
N-(2-methoxyphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242131
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245476
5-(2,4-dimethoxyanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243459
5-(2,4-dimethoxyanilino)-N-(4-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109243833
5-N-(2-methoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108873

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide (CID 109245108) is 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide is COc1ccc(Nc2cncc(C(=O)Nc3ccccc3OC)c2)c(OC)c1.
What is the InChIKey of 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is HNTMHVKAARJQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O4/c1-26-16-8-9-18(20(11-16)28-3)23-15-10-14(12-22-13-15)21(25)24-17-6-4-5-7-19(17)27-2/h4-13,23H,1-3H3,(H,24,25).
What are the key properties of 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide?
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 379.42 g/mol, XLogP of 4.10, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109245108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).