N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide

C22H22N4O2 — CID 109242868

IUPACN-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cncc(Nc3cc(C)ccc3C)c2)cc1
InChIInChI=1S/C22H22N4O2/c1-14-4-5-15(2)21(10-14)25-20-11-17(12-23-13-20)22(28)26-19-8-6-18(7-9-19)24-16(3)27/h4-13,25H,1-3H3,(H,24,27)(H,26,28)
InChIKeyYWJPANFVNGIMOP-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.65
Rot. Bonds5

About N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide

N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide (PubChem CID 109242868) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide
PubChem CID109242868
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC NameN-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cncc(Nc3cc(C)ccc3C)c2)cc1
InChIInChI=1S/C22H22N4O2/c1-14-4-5-15(2)21(10-14)25-20-11-17(12-23-13-20)22(28)26-19-8-6-18(7-9-19)24-16(3)27/h4-13,25H,1-3H3,(H,24,27)(H,26,28)
InChIKeyYWJPANFVNGIMOP-UHFFFAOYSA-N
XLogP4.65
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,5-dimethylanilino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109242013
5-(4-acetamidoanilino)-N-(2,5-dimethylphenyl)pyridine-3-carboxamide
CID 109242811
N-[4-(dimethylamino)phenyl]-5-(2,5-dimethylanilino)pyridine-3-carboxamide
CID 109242872
N-(4-cyanophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide
CID 109242887
5-(2,5-dimethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241831
N-(4-acetylphenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242751
5-(5-chloro-2-methylanilino)-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 109244563
5-[4-(diethylamino)anilino]-N-(2,5-dimethylphenyl)pyridine-3-carboxamide
CID 109242816
5-(2,5-dimethylanilino)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109242839
N-(3-acetamidophenyl)-5-(2-methylanilino)pyridine-3-carboxamide
CID 109241783
5-(3,4-difluoroanilino)-N-(2,5-dimethylphenyl)pyridine-3-carboxamide
CID 109242833
N-(3,4-dimethylphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242104

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide (CID 109242868) is N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide is CC(=O)Nc1ccc(NC(=O)c2cncc(Nc3cc(C)ccc3C)c2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide?
The InChIKey is YWJPANFVNGIMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-14-4-5-15(2)21(10-14)25-20-11-17(12-23-13-20)22(28)26-19-8-6-18(7-9-19)24-16(3)27/h4-13,25H,1-3H3,(H,24,27)(H,26,28).
What are the key properties of N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide?
N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 4.65, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-5-(2,5-dimethylanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109242868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).