bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide

C91H167F9N18O6 — CID 165091492

About bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide

bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide (PubChem CID 165091492) has the molecular formula C91H167F9N18O6 and a molecular weight of 1780.44 g/mol. Its IUPAC name is bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide.

Molecular Properties

• Compound Name: bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide
• PubChem CID: 165091492
• Molecular Formula: C91H167F9N18O6
• Molecular Weight: 1780.44 g/mol
• Exact Mass: 1779.32
• IUPAC Name: bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide
• SMILES: CC(C)C(=O)NC1(F)CN(C2CCN(C(C)C)CC2)C1.CC(C)C(=O)NC1CCN(C2CCN(C(C)C)CC2(F)F)C1.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1(F)F.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1(F)F.CC(C)C(=O)NC1CN(C2CCN(C(C)C)CC2(F)F)C1
• InChI: InChI=1S/C16H29F2N3O.3C15H27F2N3O.C15H28FN3O.C15H29N3O/c1-11(2)15(22)19-13-5-7-20(9-13)14-6-8-21(12(3)4)10-16(14,17)18;2*1-10(2)14(21)18-13-5-6-19(9-15(13,16)17)12-7-20(8-12)11(3)4;1-10(2)14(21)18-12-7-20(8-12)13-5-6-19(11(3)4)9-15(13,16)17;1-11(2)14(20)17-15(16)9-19(10-15)13-5-7-18(8-6-13)12(3)4;1-11(2)15(19)16-13-5-7-17(8-6-13)14-9-18(10-14)12(3)4/h11-14H,5-10H2,1-4H3,(H,19,22);3*10-13H,5-9H2,1-4H3,(H,18,21);11-13H,5-10H2,1-4H3,(H,17,20);11-14H,5-10H2,1-4H3,(H,16,19)
• InChIKey: WTZIRTIBTIKXGE-UHFFFAOYSA-N
• XLogP: 9.56
• TPSA: 213.48 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 18
• Rotatable Bonds: 24
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1780.44
LogP ≤ 5	9.56
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide?

The IUPAC name of bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide (CID 165091492) is bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide.

What is the SMILES notation for bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide?

The canonical SMILES for bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide is CC(C)C(=O)NC1(F)CN(C2CCN(C(C)C)CC2)C1.CC(C)C(=O)NC1CCN(C2CCN(C(C)C)CC2(F)F)C1.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1(F)F.CC(C)C(=O)NC1CCN(C2CN(C(C)C)C2)CC1(F)F.CC(C)C(=O)NC1CN(C2CCN(C(C)C)CC2(F)F)C1.

What is the InChIKey of bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide?

The InChIKey is WTZIRTIBTIKXGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29F2N3O.3C15H27F2N3O.C15H28FN3O.C15H29N3O/c1-11(2)15(22)19-13-5-7-20(9-13)14-6-8-21(12(3)4)10-16(14,17)18;2*1-10(2)14(21)18-13-5-6-19(9-15(13,16)17)12-7-20(8-12)11(3)4;1-10(2)14(21)18-12-7-20(8-12)13-5-6-19(11(3)4)9-15(13,16)17;1-11(2)14(20)17-15(16)9-19(10-15)13-5-7-18(8-6-13)12(3)4;1-11(2)15(19)16-13-5-7-17(8-6-13)14-9-18(10-14)12(3)4/h11-14H,5-10H2,1-4H3,(H,19,22);3*10-13H,5-9H2,1-4H3,(H,18,21);11-13H,5-10H2,1-4H3,(H,17,20);11-14H,5-10H2,1-4H3,(H,16,19).

What are the key properties of bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide?

bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide has a molecular weight of 1780.44 g/mol, XLogP of 9.56, 24 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for bis(N-[3,3-difluoro-1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]-2-methylpropanamide);N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;N-[1-(3,3-difluoro-1-propan-2-ylpiperidin-4-yl)pyrrolidin-3-yl]-2-methylpropanamide;N-[3-fluoro-1-(1-propan-2-ylpiperidin-4-yl)azetidin-3-yl]-2-methylpropanamide;2-methyl-N-[1-(1-propan-2-ylazetidin-3-yl)piperidin-4-yl]propanamide is sourced from PubChem (CID 165091492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).