N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide

C22H21N3O3 — CID 109178248

IUPACN-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1Nc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccn1
InChIInChI=1S/C22H21N3O3/c1-14-7-8-20(28-3)19(11-14)25-21-13-17(9-10-23-21)22(27)24-18-6-4-5-16(12-18)15(2)26/h4-13H,1-3H3,(H,23,25)(H,24,27)
InChIKeyYXFGWXZXNSMFTM-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.60
Rot. Bonds6

About N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide

N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide (PubChem CID 109178248) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
PubChem CID109178248
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
SMILESCOc1ccc(C)cc1Nc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccn1
InChIInChI=1S/C22H21N3O3/c1-14-7-8-20(28-3)19(11-14)25-21-13-17(9-10-23-21)22(27)24-18-6-4-5-16(12-18)15(2)26/h4-13H,1-3H3,(H,23,25)(H,24,27)
InChIKeyYXFGWXZXNSMFTM-UHFFFAOYSA-N
XLogP4.60
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109176882
N-(3-chloro-4-fluorophenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109177730
2-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
CID 109176772
2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109176285
N-(4-acetylphenyl)-2-(5-chloro-2-methoxyanilino)pyridine-4-carboxamide
CID 109177842
N-(3-acetylphenyl)-2-(2-propan-2-yloxyanilino)pyridine-4-carboxamide
CID 109178282
N-(3-methylphenyl)-2-(3,4,5-trimethoxyanilino)pyridine-4-carboxamide
CID 109176250
N-(3-chloro-4-methoxyphenyl)-2-(3-methylanilino)pyridine-4-carboxamide
CID 109176255
N-(4-acetamidophenyl)-2-(2-methoxyanilino)pyridine-4-carboxamide
CID 109177925
5-(3-acetylanilino)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109293781
2-(3-acetamidoanilino)-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 109177884
2-(5-chloro-2-methoxyanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109177849

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide (CID 109178248) is N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide is COc1ccc(C)cc1Nc1cc(C(=O)Nc2cccc(C(C)=O)c2)ccn1.
What is the InChIKey of N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide?
The InChIKey is YXFGWXZXNSMFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-14-7-8-20(28-3)19(11-14)25-21-13-17(9-10-23-21)22(27)24-18-6-4-5-16(12-18)15(2)26/h4-13H,1-3H3,(H,23,25)(H,24,27).
What are the key properties of N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide?
N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 4.60, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide is sourced from PubChem (CID 109178248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).