5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide

C21H21N3O2 — CID 109197177

IUPAC5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccccc2C)nc1
InChIInChI=1S/C21H21N3O2/c1-3-26-20-11-7-6-10-18(20)23-16-12-13-19(22-14-16)21(25)24-17-9-5-4-8-15(17)2/h4-14,23H,3H2,1-2H3,(H,24,25)
InChIKeyLOLREXXRLLDOTD-UHFFFAOYSA-N
MW347.42 g/mol
LogP4.78
Rot. Bonds6

About 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide

5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide (PubChem CID 109197177) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
PubChem CID109197177
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccccc2C)nc1
InChIInChI=1S/C21H21N3O2/c1-3-26-20-11-7-6-10-18(20)23-16-12-13-19(22-14-16)21(25)24-17-9-5-4-8-15(17)2/h4-14,23H,3H2,1-2H3,(H,24,25)
InChIKeyLOLREXXRLLDOTD-UHFFFAOYSA-N
XLogP4.78
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109198092
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-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059
6-N-(2-ethoxyphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100070
5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181135
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197157
5-(4-fluoroanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197166
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-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109189418

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide (CID 109197177) is 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)Nc2ccccc2C)nc1.
What is the InChIKey of 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
The InChIKey is LOLREXXRLLDOTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-3-26-20-11-7-6-10-18(20)23-16-12-13-19(22-14-16)21(25)24-17-9-5-4-8-15(17)2/h4-14,23H,3H2,1-2H3,(H,24,25).
What are the key properties of 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide?
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 4.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109197177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).