5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide

C21H21N3O — CID 109197300

IUPAC5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)Nc2cccc(C)c2)nc1
InChIInChI=1S/C21H21N3O/c1-3-16-8-4-5-10-19(16)23-18-11-12-20(22-14-18)21(25)24-17-9-6-7-15(2)13-17/h4-14,23H,3H2,1-2H3,(H,24,25)
InChIKeySHZRAEMSJCRRNC-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.95
Rot. Bonds5

About 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide

5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide (PubChem CID 109197300) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
PubChem CID109197300
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC Name5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)Nc2cccc(C)c2)nc1
InChIInChI=1S/C21H21N3O/c1-3-16-8-4-5-10-19(16)23-18-11-12-20(22-14-18)21(25)24-17-9-6-7-15(2)13-17/h4-14,23H,3H2,1-2H3,(H,24,25)
InChIKeySHZRAEMSJCRRNC-UHFFFAOYSA-N
XLogP4.95
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241836
N-(3-methylphenyl)-5-[4-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109197325
N-(3-acetylphenyl)-5-(2-methylanilino)pyridine-2-carboxamide
CID 109197257
5-(3,5-dimethylanilino)-N-phenylpyridine-2-carboxamide
CID 109196969
N-(3-chloro-4-fluorophenyl)-5-(3-methylanilino)pyridine-2-carboxamide
CID 109197376
5-(3-cyanoanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109197351
5-(3-chloro-4-fluoroanilino)-N-(3-methylphenyl)pyridine-2-carboxamide
CID 109197308
N-(3-acetamidophenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127909
N-(3-acetylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109199996
N-(3-bromophenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109199748
N-(3,4-dimethylphenyl)-5-(2-ethoxyanilino)pyridine-2-carboxamide
CID 109198092
N-[(2-methoxyphenyl)methyl]-5-(3-methylanilino)pyridine-2-carboxamide
CID 109190188

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide (CID 109197300) is 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide is CCc1ccccc1Nc1ccc(C(=O)Nc2cccc(C)c2)nc1.
What is the InChIKey of 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide?
The InChIKey is SHZRAEMSJCRRNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c1-3-16-8-4-5-10-19(16)23-18-11-12-20(22-14-18)21(25)24-17-9-6-7-15(2)13-17/h4-14,23H,3H2,1-2H3,(H,24,25).
What are the key properties of 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide?
5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 4.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109197300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).