[8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

C19H23FN4O3 — CID 131671797

About [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

[8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (PubChem CID 131671797) has the molecular formula C19H23FN4O3 and a molecular weight of 374.42 g/mol. Its IUPAC name is [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.

Molecular Properties

• Compound Name: [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
• PubChem CID: 131671797
• Molecular Formula: C19H23FN4O3
• Molecular Weight: 374.42 g/mol
• Exact Mass: 374.18
• IUPAC Name: [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
• SMILES: Cc1cc(C(=O)N2CC3(CC(COc4ncccc4F)CCN3C)C2)no1
• InChI: InChI=1S/C19H23FN4O3/c1-13-8-16(22-27-13)18(25)24-11-19(12-24)9-14(5-7-23(19)2)10-26-17-15(20)4-3-6-21-17/h3-4,6,8,14H,5,7,9-12H2,1-2H3
• InChIKey: JXJUIJDKTRHZKX-UHFFFAOYSA-N
• XLogP: 2.13
• TPSA: 71.70 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	374.42
LogP ≤ 5	2.13
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?

The IUPAC name of [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (CID 131671797) is [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.

What is the SMILES notation for [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?

The canonical SMILES for [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is Cc1cc(C(=O)N2CC3(CC(COc4ncccc4F)CCN3C)C2)no1.

What is the InChIKey of [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?

The InChIKey is JXJUIJDKTRHZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN4O3/c1-13-8-16(22-27-13)18(25)24-11-19(12-24)9-14(5-7-23(19)2)10-26-17-15(20)4-3-6-21-17/h3-4,6,8,14H,5,7,9-12H2,1-2H3.

What are the key properties of [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?

[8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone has a molecular weight of 374.42 g/mol, XLogP of 2.13, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for [8-[(3-fluoro-2-pyridinyl)oxymethyl]-5-methyl-2,5-diazaspiro[3.5]nonan-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 131671797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).