1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide

C19H18FN5O4S — CID 154724997

About 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide

1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide (PubChem CID 154724997) has the molecular formula C19H18FN5O4S and a molecular weight of 431.45 g/mol. Its IUPAC name is 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

• Compound Name: 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide
• PubChem CID: 154724997
• Molecular Formula: C19H18FN5O4S
• Molecular Weight: 431.45 g/mol
• Exact Mass: 431.11
• IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide
• SMILES: O=C(Nc1nnc(-c2ccccn2)o1)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1
• InChI: InChI=1S/C19H18FN5O4S/c20-14-4-6-15(7-5-14)30(27,28)25-11-8-13(9-12-25)17(26)22-19-24-23-18(29-19)16-3-1-2-10-21-16/h1-7,10,13H,8-9,11-12H2,(H,22,24,26)
• InChIKey: BYYASYVYZFBCQS-UHFFFAOYSA-N
• XLogP: 2.31
• TPSA: 118.29 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	431.45
LogP ≤ 5	2.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide?

The IUPAC name of 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide (CID 154724997) is 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide.

What is the SMILES notation for 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide?

The canonical SMILES for 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide is O=C(Nc1nnc(-c2ccccn2)o1)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1.

What is the InChIKey of 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide?

The InChIKey is BYYASYVYZFBCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5O4S/c20-14-4-6-15(7-5-14)30(27,28)25-11-8-13(9-12-25)17(26)22-19-24-23-18(29-19)16-3-1-2-10-21-16/h1-7,10,13H,8-9,11-12H2,(H,22,24,26).

What are the key properties of 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide?

1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 431.45 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-fluorophenyl)sulfonyl-N-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 154724997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).