butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc

C160H304F48N32Zn8-32 — CID 167575387

About butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc

butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc (PubChem CID 167575387) has the molecular formula C160H304F48N32Zn8-32 and a molecular weight of 4111.44 g/mol. Its IUPAC name is butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc.

Molecular Properties

• Compound Name: butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc
• PubChem CID: 167575387
• Molecular Formula: C160H304F48N32Zn8-32
• Molecular Weight: 4111.44 g/mol
• Exact Mass: 4097.85
• IUPAC Name: butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc
• SMILES: CC(C)C(CC([N-]C(C)(C)C)C(F)(F)F)[N-]C(C)(C)C.CC(C)C(CC([N-]C(C)(C)C)C(F)(F)F)[N-]C(C)(C)C.CC(C)[N-]C(C)CC([N-]C(C)C)C(F)(F)F.CC(C)[N-]C(C)CC([N-]C(C)C)C(F)(F)F.CCC(C)[N-]C(CC)CC([N-]C(C)CC)C(F)(F)F.CCC(CC([N-]C(C)C)C(F)(F)F)[N-]C(C)C.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(CC)CC([N-]CC)C(F)(F)F.CC[N-]C(CC)CC([N-]CC)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn]
• InChI: InChI=1S/2C15H29F3N2.C14H27F3N2.C12H23F3N2.2C11H21F3N2.2C10H19F3N2.3C9H17F3N2.5C7H13F3N2.8Zn/c2*1-10(2)11(19-13(3,4)5)9-12(15(16,17)18)20-14(6,7)8;1-6-10(4)18-12(8-3)9-13(14(15,16)17)19-11(5)7-2;1-6-10(16-8(2)3)7-11(12(13,14)15)17-9(4)5;2*1-7(2)15-9(5)6-10(11(12,13)14)16-8(3)4;2*1-4-8(14-5-2)7-9(15-6-3)10(11,12)13;3*1-4-13-7(3)6-8(14-5-2)9(10,11)12;5*1-5(11-2)4-6(12-3)7(8,9)10;;;;;;;;/h2*10-12H,9H2,1-8H3;10-13H,6-9H2,1-5H3;8-11H,6-7H2,1-5H3;2*7-10H,6H2,1-5H3;2*8-9H,4-7H2,1-3H3;3*7-8H,4-6H2,1-3H3;5*5-6H,4H2,1-3H3;;;;;;;;/q16*-2
• InChIKey: KQJFDEGXRREKIQ-UHFFFAOYSA-N
• XLogP: 61.64
• TPSA: 451.20 Ų
• Rotatable Bonds: 90
• Heavy Atoms: 248
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4111.44
LogP ≤ 5	61.64
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc?

The IUPAC name of butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc (CID 167575387) is butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc.

What is the SMILES notation for butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc?

The canonical SMILES for butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc is CC(C)C(CC([N-]C(C)(C)C)C(F)(F)F)[N-]C(C)(C)C.CC(C)C(CC([N-]C(C)(C)C)C(F)(F)F)[N-]C(C)(C)C.CC(C)[N-]C(C)CC([N-]C(C)C)C(F)(F)F.CC(C)[N-]C(C)CC([N-]C(C)C)C(F)(F)F.CCC(C)[N-]C(CC)CC([N-]C(C)CC)C(F)(F)F.CCC(CC([N-]C(C)C)C(F)(F)F)[N-]C(C)C.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(C)CC([N-]CC)C(F)(F)F.CC[N-]C(CC)CC([N-]CC)C(F)(F)F.CC[N-]C(CC)CC([N-]CC)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.C[N-]C(C)CC([N-]C)C(F)(F)F.[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].[Zn].

What is the InChIKey of butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc?

The InChIKey is KQJFDEGXRREKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H29F3N2.C14H27F3N2.C12H23F3N2.2C11H21F3N2.2C10H19F3N2.3C9H17F3N2.5C7H13F3N2.8Zn/c2*1-10(2)11(19-13(3,4)5)9-12(15(16,17)18)20-14(6,7)8;1-6-10(4)18-12(8-3)9-13(14(15,16)17)19-11(5)7-2;1-6-10(16-8(2)3)7-11(12(13,14)15)17-9(4)5;2*1-7(2)15-9(5)6-10(11(12,13)14)16-8(3)4;2*1-4-8(14-5-2)7-9(15-6-3)10(11,12)13;3*1-4-13-7(3)6-8(14-5-2)9(10,11)12;5*1-5(11-2)4-6(12-3)7(8,9)10;;;;;;;;/h2*10-12H,9H2,1-8H3;10-13H,6-9H2,1-5H3;8-11H,6-7H2,1-5H3;2*7-10H,6H2,1-5H3;2*8-9H,4-7H2,1-3H3;3*7-8H,4-6H2,1-3H3;5*5-6H,4H2,1-3H3;;;;;;;;/q16*-2;;;;;;;;.

What are the key properties of butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc?

butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc has a molecular weight of 4111.44 g/mol, XLogP of 61.64, 90 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for butan-2-yl-(4-butan-2-ylazanidyl-1,1,1-trifluorohexan-2-yl)azanide;bis(tert-butyl-(4-tert-butylazanidyl-1,1,1-trifluoro-5-methylhexan-2-yl)azanide);bis(ethyl-(4-ethylazanidyl-1,1,1-trifluorohexan-2-yl)azanide);tris(ethyl-(4-ethylazanidyl-1,1,1-trifluoropentan-2-yl)azanide);pentakis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylhexan-2-yl)azanide;bis(propan-2-yl-(1,1,1-trifluoro-4-propan-2-ylazanidylpentan-2-yl)azanide);zinc is sourced from PubChem (CID 167575387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).