N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide

C22H23N3O4 — CID 109200105

IUPACN-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(Nc3cc(C)ccc3OC)cn2)c1
InChIInChI=1S/C22H23N3O4/c1-14-5-9-20(28-3)18(11-14)24-15-6-8-17(23-13-15)22(26)25-19-12-16(27-2)7-10-21(19)29-4/h5-13,24H,1-4H3,(H,25,26)
InChIKeySJQBRBVETQEFAL-UHFFFAOYSA-N
MW393.44 g/mol
LogP4.41
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide

N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide (PubChem CID 109200105) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
PubChem CID109200105
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC NameN-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(Nc3cc(C)ccc3OC)cn2)c1
InChIInChI=1S/C22H23N3O4/c1-14-5-9-20(28-3)18(11-14)24-15-6-8-17(23-13-15)22(26)25-19-12-16(27-2)7-10-21(19)29-4/h5-13,24H,1-4H3,(H,25,26)
InChIKeySJQBRBVETQEFAL-UHFFFAOYSA-N
XLogP4.41
TPSA81.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109198963
5-(5-chloro-2-methylanilino)-N-(2,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 109199397
N-(2,5-dimethoxyphenyl)-5-(2,6-dimethylanilino)pyridine-2-carboxamide
CID 109198260
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-2-carboxamide
CID 109199091
N-(2-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109198831
5-hydrazinyl-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 104642218
N-(4-acetylphenyl)-5-(2,5-dimethoxyanilino)pyridine-2-carboxamide
CID 109200201
5-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109198259
5-(2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199964
N-(2,5-dimethoxyphenyl)-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179771
5-(ethylamino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 104639774
N-(2,5-dimethoxyphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179374

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide (CID 109200105) is N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(Nc3cc(C)ccc3OC)cn2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide?
The InChIKey is SJQBRBVETQEFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-14-5-9-20(28-3)18(11-14)24-15-6-8-17(23-13-15)22(26)25-19-12-16(27-2)7-10-21(19)29-4/h5-13,24H,1-4H3,(H,25,26).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide?
N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide has a molecular weight of 393.44 g/mol, XLogP of 4.41, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109200105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).