6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

C22H23N3O3 — CID 109164093

IUPAC6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2cc(C)ccc2OC)cn1
InChIInChI=1S/C22H23N3O3/c1-4-28-20-8-6-5-7-17(20)24-21-12-10-16(14-23-21)22(26)25-18-13-15(2)9-11-19(18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyXXOHAQZHECXUJT-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.79
Rot. Bonds7

About 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 109164093) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
PubChem CID109164093
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2cc(C)ccc2OC)cn1
InChIInChI=1S/C22H23N3O3/c1-4-28-20-8-6-5-7-17(20)24-21-12-10-16(14-23-21)22(26)25-18-13-15(2)9-11-19(18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyXXOHAQZHECXUJT-UHFFFAOYSA-N
XLogP4.79
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (CID 109164093) is 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)Nc2cc(C)ccc2OC)cn1.
What is the InChIKey of 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is XXOHAQZHECXUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-4-28-20-8-6-5-7-17(20)24-21-12-10-16(14-23-21)22(26)25-18-13-15(2)9-11-19(18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26).
What are the key properties of 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.79, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109164093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).