1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide

C15H21FN4O3 — CID 91960091

About 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide

1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide (PubChem CID 91960091) has the molecular formula C15H21FN4O3 and a molecular weight of 324.36 g/mol. Its IUPAC name is 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide.

Molecular Properties

• Compound Name: 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide
• PubChem CID: 91960091
• Molecular Formula: C15H21FN4O3
• Molecular Weight: 324.36 g/mol
• Exact Mass: 324.16
• IUPAC Name: 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide
• SMILES: CC(C)NC(=O)C1CCCN(C(=O)c2nn3c(c2F)OCC3)C1
• InChI: InChI=1S/C15H21FN4O3/c1-9(2)17-13(21)10-4-3-5-19(8-10)14(22)12-11(16)15-20(18-12)6-7-23-15/h9-10H,3-8H2,1-2H3,(H,17,21)
• InChIKey: KVNCGMHWTXLMSS-UHFFFAOYSA-N
• XLogP: 0.79
• TPSA: 76.46 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	324.36
LogP ≤ 5	0.79
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide?

The IUPAC name of 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide (CID 91960091) is 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide.

What is the SMILES notation for 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide?

The canonical SMILES for 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide is CC(C)NC(=O)C1CCCN(C(=O)c2nn3c(c2F)OCC3)C1.

What is the InChIKey of 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide?

The InChIKey is KVNCGMHWTXLMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN4O3/c1-9(2)17-13(21)10-4-3-5-19(8-10)14(22)12-11(16)15-20(18-12)6-7-23-15/h9-10H,3-8H2,1-2H3,(H,17,21).

What are the key properties of 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide?

1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide has a molecular weight of 324.36 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(7-fluoro-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carbonyl)-N-propan-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 91960091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).