N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide

C22H23N3O2 — CID 109198092

IUPACN-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C22H23N3O2/c1-4-27-21-8-6-5-7-19(21)24-18-11-12-20(23-14-18)22(26)25-17-10-9-15(2)16(3)13-17/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyCXWMDOQIEHRADT-UHFFFAOYSA-N
MW361.45 g/mol
LogP5.09
Rot. Bonds6

About N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide

N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide (PubChem CID 109198092) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
PubChem CID109198092
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C22H23N3O2/c1-4-27-21-8-6-5-7-19(21)24-18-11-12-20(23-14-18)22(26)25-17-10-9-15(2)16(3)13-17/h5-14,24H,4H2,1-3H3,(H,25,26)
InChIKeyCXWMDOQIEHRADT-UHFFFAOYSA-N
XLogP5.09
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.45
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
methyl 4-[[5-(2-ethoxyanilino)pyridine-2-carbonyl]amino]benzoate
CID 109200002
N-(2,6-difluorophenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109200015
5-(3-acetamidoanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199969
5-(2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199964
5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181135
N-(3-chloro-4-methoxyphenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109199580
6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127101
5-(2-ethoxyanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290053
4-(2-ethoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219228
5-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109242967

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide (CID 109198092) is N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)c(C)c2)nc1.
What is the InChIKey of N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide?
The InChIKey is CXWMDOQIEHRADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-4-27-21-8-6-5-7-19(21)24-18-11-12-20(23-14-18)22(26)25-17-10-9-15(2)16(3)13-17/h5-14,24H,4H2,1-3H3,(H,25,26).
What are the key properties of N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide?
N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 5.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109198092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).