5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide

C19H19N3O2 — CID 109187557

IUPAC5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)NCc2ccco2)nc1
InChIInChI=1S/C19H19N3O2/c1-2-14-6-3-4-8-17(14)22-15-9-10-18(20-12-15)19(23)21-13-16-7-5-11-24-16/h3-12,22H,2,13H2,1H3,(H,21,23)
InChIKeyFJYGWKOXDJSENB-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.91
Rot. Bonds6

About 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide

5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 109187557) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID109187557
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)NCc2ccco2)nc1
InChIInChI=1S/C19H19N3O2/c1-2-14-6-3-4-8-17(14)22-15-9-10-18(20-12-15)19(23)21-13-16-7-5-11-24-16/h3-12,22H,2,13H2,1H3,(H,21,23)
InChIKeyFJYGWKOXDJSENB-UHFFFAOYSA-N
XLogP3.91
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide (CID 109187557) is 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide is CCc1ccccc1Nc1ccc(C(=O)NCc2ccco2)nc1.
What is the InChIKey of 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is FJYGWKOXDJSENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-2-14-6-3-4-8-17(14)22-15-9-10-18(20-12-15)19(23)21-13-16-7-5-11-24-16/h3-12,22H,2,13H2,1H3,(H,21,23).
What are the key properties of 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109187557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).