5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide

C21H21N3O2 — CID 109197592

IUPAC5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)N(C)c2ccccc2)nc1
InChIInChI=1S/C21H21N3O2/c1-3-26-20-12-8-7-11-18(20)23-16-13-14-19(22-15-16)21(25)24(2)17-9-5-4-6-10-17/h4-15,23H,3H2,1-2H3
InChIKeyHPHYGHPLSXEMHL-UHFFFAOYSA-N
MW347.42 g/mol
LogP4.50
Rot. Bonds6

About 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide

5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide (PubChem CID 109197592) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
PubChem CID109197592
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)N(C)c2ccccc2)nc1
InChIInChI=1S/C21H21N3O2/c1-3-26-20-12-8-7-11-18(20)23-16-13-14-19(22-15-16)21(25)24(2)17-9-5-4-6-10-17/h4-15,23H,3H2,1-2H3
InChIKeyHPHYGHPLSXEMHL-UHFFFAOYSA-N
XLogP4.50
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-ethoxyanilino)-N-methyl-N-phenylpyrazine-2-carboxamide
CID 109290242
N-methyl-N-phenyl-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109197573
5-(2,5-dimethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197597
N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide
CID 109179331
5-(5-chloro-2-methoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197586
5-(2-ethoxyanilino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181135
methyl 4-[[6-[methyl(phenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109197609
5-(2-ethoxyanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197177
5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197604
5-(3,5-dimethylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197567
N-methyl-5-(2-morpholin-4-ylanilino)-N-phenylpyridine-2-carboxamide
CID 109197615
5-(3,5-dichloroanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197632

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The IUPAC name of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide (CID 109197592) is 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)N(C)c2ccccc2)nc1.
What is the InChIKey of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The InChIKey is HPHYGHPLSXEMHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-3-26-20-12-8-7-11-18(20)23-16-13-14-19(22-15-16)21(25)24(2)17-9-5-4-6-10-17/h4-15,23H,3H2,1-2H3.
What are the key properties of 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 4.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109197592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).