6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane

C35H38F4N6 — CID 159786209

About 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane

6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane (PubChem CID 159786209) has the molecular formula C35H38F4N6 and a molecular weight of 618.72 g/mol. Its IUPAC name is 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane.

Molecular Properties

• Compound Name: 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane
• PubChem CID: 159786209
• Molecular Formula: C35H38F4N6
• Molecular Weight: 618.72 g/mol
• Exact Mass: 618.31
• IUPAC Name: 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane
• SMILES: C.C.FC1(F)C2CN(c3cccc(N=C(c4ccccc4)c4ccccc4)n3)CC21.Nc1cccc(N2CC3C(C2)C3(F)F)n1
• InChI: InChI=1S/C23H19F2N3.C10H11F2N3.2CH4/c24-23(25)18-14-28(15-19(18)23)21-13-7-12-20(26-21)27-22(16-8-3-1-4-9-16)17-10-5-2-6-11-17;11-10(12)6-4-15(5-7(6)10)9-3-1-2-8(13)14-9;;/h1-13,18-19H,14-15H2;1-3,6-7H,4-5H2,(H2,13,14);2*1H4
• InChIKey: NHZBUUYKFZOZBN-UHFFFAOYSA-N
• XLogP: 7.59
• TPSA: 70.64 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 45
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	618.72
LogP ≤ 5	7.59
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane?

The IUPAC name of 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane (CID 159786209) is 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane.

What is the SMILES notation for 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane?

The canonical SMILES for 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane is C.C.FC1(F)C2CN(c3cccc(N=C(c4ccccc4)c4ccccc4)n3)CC21.Nc1cccc(N2CC3C(C2)C3(F)F)n1.

What is the InChIKey of 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane?

The InChIKey is NHZBUUYKFZOZBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F2N3.C10H11F2N3.2CH4/c24-23(25)18-14-28(15-19(18)23)21-13-7-12-20(26-21)27-22(16-8-3-1-4-9-16)17-10-5-2-6-11-17;11-10(12)6-4-15(5-7(6)10)9-3-1-2-8(13)14-9;;/h1-13,18-19H,14-15H2;1-3,6-7H,4-5H2,(H2,13,14);2*1H4.

What are the key properties of 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane?

6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane has a molecular weight of 618.72 g/mol, XLogP of 7.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)pyridin-2-amine;N-[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-2-pyridinyl]-1,1-diphenylmethanimine;methane is sourced from PubChem (CID 159786209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).