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

C21H21N3O — CID 109241654

IUPAC5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide
SMILESCCN(c1ccccc1)c1cncc(C(=O)Nc2ccccc2C)c1
InChIInChI=1S/C21H21N3O/c1-3-24(18-10-5-4-6-11-18)19-13-17(14-22-15-19)21(25)23-20-12-8-7-9-16(20)2/h4-15H,3H2,1-2H3,(H,23,25)
InChIKeyODZFPOBJEIGQND-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.80
Rot. Bonds5

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

5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide (PubChem CID 109241654) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide
PubChem CID109241654
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC Name5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide
SMILESCCN(c1ccccc1)c1cncc(C(=O)Nc2ccccc2C)c1
InChIInChI=1S/C21H21N3O/c1-3-24(18-10-5-4-6-11-18)19-13-17(14-22-15-19)21(25)23-20-12-8-7-9-16(20)2/h4-15H,3H2,1-2H3,(H,23,25)
InChIKeyODZFPOBJEIGQND-UHFFFAOYSA-N
XLogP4.80
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(N-ethylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-3-carboxamide
CID 109243612
5-(N-ethylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109243659
N-(3-acetamidophenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243646
N-(2,5-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243638
N-benzyl-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109231703
methyl 2-[[5-(N-ethyl-3-methylanilino)pyridine-3-carbonyl]amino]benzoate
CID 109245916
N-(3,4-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243640
5-(N-ethyl-3-methylanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245566
5-N-(2-methylphenyl)-3-N-prop-2-enylpyridine-3,5-dicarboxamide
CID 109101805
N-ethyl-5-(N-ethylanilino)-N-phenylpyridine-3-carboxamide
CID 109243544
6-(N-ethylanilino)-N-(2-methylphenyl)pyrimidine-4-carboxamide
CID 109355985
N-(2,4-dimethylphenyl)-2-(N-ethylanilino)pyrimidine-5-carboxamide
CID 109266377

Frequently Asked Questions

What is the IUPAC name of 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide (CID 109241654) is 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide is CCN(c1ccccc1)c1cncc(C(=O)Nc2ccccc2C)c1.
What is the InChIKey of 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide?
The InChIKey is ODZFPOBJEIGQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c1-3-24(18-10-5-4-6-11-18)19-13-17(14-22-15-19)21(25)23-20-12-8-7-9-16(20)2/h4-15H,3H2,1-2H3,(H,23,25).
What are the key properties of 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide?
5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N-ethylanilino)-N-(2-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109241654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).