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

C21H21N3O4 — CID 109245203

IUPAC5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2cncc(Nc3cc(OC)ccc3OC)c2)c1
InChIInChI=1S/C21H21N3O4/c1-26-17-6-4-5-15(10-17)24-21(25)14-9-16(13-22-12-14)23-19-11-18(27-2)7-8-20(19)28-3/h4-13,23H,1-3H3,(H,24,25)
InChIKeyCBGMSOKXKJFRLL-UHFFFAOYSA-N
MW379.42 g/mol
LogP4.10
Rot. Bonds7

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

5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 109245203) has the molecular formula C21H21N3O4 and a molecular weight of 379.42 g/mol. Its IUPAC name is 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
PubChem CID109245203
Molecular FormulaC21H21N3O4
Molecular Weight379.42 g/mol
Exact Mass379.15
IUPAC Name5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2cncc(Nc3cc(OC)ccc3OC)c2)c1
InChIInChI=1S/C21H21N3O4/c1-26-17-6-4-5-15(10-17)24-21(25)14-9-16(13-22-12-14)23-19-11-18(27-2)7-8-20(19)28-3/h4-13,23H,1-3H3,(H,24,25)
InChIKeyCBGMSOKXKJFRLL-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

5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109243138
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109244383
5-(2,5-dimethoxyanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109244111
5-(2,5-dimethoxyanilino)-N-(4-ethylphenyl)pyridine-3-carboxamide
CID 109243458
5-N-(2-methoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108873
5-(2,4-dimethoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245660
5-(3-acetylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109245209
5-(2,5-dimethoxyanilino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223294
5-(2,4-dimethylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109242737
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2,5-dimethoxyphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109244180
5-(5-chloro-2-methoxyanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109245063

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide (CID 109245203) is 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide is COc1cccc(NC(=O)c2cncc(Nc3cc(OC)ccc3OC)c2)c1.
What is the InChIKey of 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is CBGMSOKXKJFRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O4/c1-26-17-6-4-5-15(10-17)24-21(25)14-9-16(13-22-12-14)23-19-11-18(27-2)7-8-20(19)28-3/h4-13,23H,1-3H3,(H,24,25).
What are the key properties of 5-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide?
5-(2,5-dimethoxyanilino)-N-(3-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-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109245203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).