1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

C19H21N5O3 — CID 72909372

About 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (PubChem CID 72909372) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

• Compound Name: 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
• PubChem CID: 72909372
• Molecular Formula: C19H21N5O3
• Molecular Weight: 367.41 g/mol
• Exact Mass: 367.16
• IUPAC Name: 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
• SMILES: O=C(NCc1nc(-c2cccnc2)no1)C1CCCN(Cc2ccco2)C1
• InChI: InChI=1S/C19H21N5O3/c25-19(15-5-2-8-24(12-15)13-16-6-3-9-26-16)21-11-17-22-18(23-27-17)14-4-1-7-20-10-14/h1,3-4,6-7,9-10,15H,2,5,8,11-13H2,(H,21,25)
• InChIKey: YQJUMMGTQFDHQH-UHFFFAOYSA-N
• XLogP: 2.25
• TPSA: 97.29 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	367.41
LogP ≤ 5	2.25
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?

The IUPAC name of 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (CID 72909372) is 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.

What is the SMILES notation for 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?

The canonical SMILES for 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is O=C(NCc1nc(-c2cccnc2)no1)C1CCCN(Cc2ccco2)C1.

What is the InChIKey of 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?

The InChIKey is YQJUMMGTQFDHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c25-19(15-5-2-8-24(12-15)13-16-6-3-9-26-16)21-11-17-22-18(23-27-17)14-4-1-7-20-10-14/h1,3-4,6-7,9-10,15H,2,5,8,11-13H2,(H,21,25).

What are the key properties of 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?

1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(furan-2-ylmethyl)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 72909372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).