N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide

C22H23N3O3 — CID 109188808

IUPACN-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NCc3ccc(C)cc3)cn2)c(OC)c1
InChIInChI=1S/C22H23N3O3/c1-15-4-6-16(7-5-15)13-23-17-8-10-20(24-14-17)22(26)25-19-11-9-18(27-2)12-21(19)28-3/h4-12,14,23H,13H2,1-3H3,(H,25,26)
InChIKeyIJNRZYAUJSAYSR-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.27
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide

N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide (PubChem CID 109188808) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
PubChem CID109188808
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NCc3ccc(C)cc3)cn2)c(OC)c1
InChIInChI=1S/C22H23N3O3/c1-15-4-6-16(7-5-15)13-23-17-8-10-20(24-14-17)22(26)25-19-11-9-18(27-2)12-21(19)28-3/h4-12,14,23H,13H2,1-3H3,(H,25,26)
InChIKeyIJNRZYAUJSAYSR-UHFFFAOYSA-N
XLogP4.27
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190528
N-(2,4-dimethoxyphenyl)-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109256303
N-(2,4-dimethoxyphenyl)-6-methyl-2-[(4-methylphenyl)methylamino]pyrimidine-4-carboxamide
CID 109327859
N-(2,4-dimethoxyphenyl)-5-(4-ethylanilino)pyridine-2-carboxamide
CID 109198459
N-(3,4-dimethoxyphenyl)-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190530
N-(4-acetamidophenyl)-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190534
N-[(4-methoxyphenyl)methyl]-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190354
5-[(4-methoxyphenyl)methylamino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 109190552
5-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109200219
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190329
5-(ethylamino)-N-(4-methoxy-2-methylphenyl)pyridine-2-carboxamide
CID 104641184
methyl 4-[[5-[(4-methylphenyl)methylamino]pyridine-2-carbonyl]amino]benzoate
CID 109188819

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide (CID 109188808) is N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide is COc1ccc(NC(=O)c2ccc(NCc3ccc(C)cc3)cn2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
The InChIKey is IJNRZYAUJSAYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15-4-6-16(7-5-15)13-23-17-8-10-20(24-14-17)22(26)25-19-11-9-18(27-2)12-21(19)28-3/h4-12,14,23H,13H2,1-3H3,(H,25,26).
What are the key properties of N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide?
N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-5-[(4-methylphenyl)methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109188808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).