[1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite

C16H24FN3O — CID 165121714

About [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite

[1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite (PubChem CID 165121714) has the molecular formula C16H24FN3O and a molecular weight of 293.39 g/mol. Its IUPAC name is [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite.

Molecular Properties

• Compound Name: [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite
• PubChem CID: 165121714
• Molecular Formula: C16H24FN3O
• Molecular Weight: 293.39 g/mol
• Exact Mass: 293.19
• IUPAC Name: [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite
• SMILES: FOC1CCCN(CCCc2ccc3c(n2)NCCC3)C1
• InChI: InChI=1S/C16H24FN3O/c17-21-15-6-3-11-20(12-15)10-2-5-14-8-7-13-4-1-9-18-16(13)19-14/h7-8,15H,1-6,9-12H2,(H,18,19)
• InChIKey: XYKFSMRZXITSNJ-UHFFFAOYSA-N
• XLogP: 2.74
• TPSA: 37.39 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	293.39
LogP ≤ 5	2.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite?

The IUPAC name of [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite (CID 165121714) is [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite.

What is the SMILES notation for [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite?

The canonical SMILES for [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite is FOC1CCCN(CCCc2ccc3c(n2)NCCC3)C1.

What is the InChIKey of [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite?

The InChIKey is XYKFSMRZXITSNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O/c17-21-15-6-3-11-20(12-15)10-2-5-14-8-7-13-4-1-9-18-16(13)19-14/h7-8,15H,1-6,9-12H2,(H,18,19).

What are the key properties of [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite?

[1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite has a molecular weight of 293.39 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]piperidin-3-yl] hypofluorite is sourced from PubChem (CID 165121714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).