4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide

C19H23N3O3 — CID 109085186

IUPAC4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCC1CCCCN1C(=O)c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C19H23N3O3/c1-2-15-6-3-4-10-22(15)19(24)14-8-9-20-17(12-14)18(23)21-13-16-7-5-11-25-16/h5,7-9,11-12,15H,2-4,6,10,13H2,1H3,(H,21,23)
InChIKeyDWGSDDJMWSDKLG-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.01
Rot. Bonds5

About 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide

4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 109085186) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID109085186
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESCCC1CCCCN1C(=O)c1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C19H23N3O3/c1-2-15-6-3-4-10-22(15)19(24)14-8-9-20-17(12-14)18(23)21-13-16-7-5-11-25-16/h5,7-9,11-12,15H,2-4,6,10,13H2,1H3,(H,21,23)
InChIKeyDWGSDDJMWSDKLG-UHFFFAOYSA-N
XLogP3.01
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide (CID 109085186) is 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide is CCC1CCCCN1C(=O)c1ccnc(C(=O)NCc2ccco2)c1.
What is the InChIKey of 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is DWGSDDJMWSDKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-2-15-6-3-4-10-22(15)19(24)14-8-9-20-17(12-14)18(23)21-13-16-7-5-11-25-16/h5,7-9,11-12,15H,2-4,6,10,13H2,1H3,(H,21,23).
What are the key properties of 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpiperidine-1-carbonyl)-N-(furan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109085186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).