N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine

C110H127N3 — CID 159537097

About N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine

N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine (PubChem CID 159537097) has the molecular formula C110H127N3 and a molecular weight of 1505.33 g/mol. Its IUPAC name is N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine.

Molecular Properties

• Compound Name: N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine
• PubChem CID: 159537097
• Molecular Formula: C110H127N3
• Molecular Weight: 1505.33 g/mol
• Exact Mass: 1504.09
• IUPAC Name: N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine
• SMILES: [2H]C(C)(C)c1cccc(-c2ccccc2)c1N(c1c(C([2H])(C)C)ccc2c1C(C)(C)c1ccccc1-2)C(C)(C)C.[2H]C(C)c1cccc(-c2ccccc2)c1N(c1c(C(C)C)ccc2c1C(C)(C)c1ccccc1-2)C(C)(C)C.[2H]C([2H])([2H])C([2H])(C)c1ccc2c(c1N(c1c(-c3ccccc3)cccc1C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])C(C)(C)C)C(C)(C)c1ccccc1-2
• InChI: InChI=1S/2C37H43N.C36H41N/c2*1-24(2)27-19-15-20-29(26-16-11-10-12-17-26)34(27)38(36(5,6)7)35-28(25(3)4)22-23-31-30-18-13-14-21-32(30)37(8,9)33(31)35;1-9-25-18-15-20-28(26-16-11-10-12-17-26)33(25)37(35(4,5)6)34-27(24(2)3)22-23-30-29-19-13-14-21-31(29)36(7,8)32(30)34/h2*10-25H,1-9H3;10-24H,9H2,1-8H3/i1D3,2D3,3D3,24D,25D;24D,25D;9D
• InChIKey: MDSQHAJDSZBFMS-ZHLLTNJZSA-N
• XLogP: 31.97
• TPSA: 9.72 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 18
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1505.33
LogP ≤ 5	31.97
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine?

The IUPAC name of N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine (CID 159537097) is N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine.

What is the SMILES notation for N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine?

The canonical SMILES for N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine is [2H]C(C)(C)c1cccc(-c2ccccc2)c1N(c1c(C([2H])(C)C)ccc2c1C(C)(C)c1ccccc1-2)C(C)(C)C.[2H]C(C)c1cccc(-c2ccccc2)c1N(c1c(C(C)C)ccc2c1C(C)(C)c1ccccc1-2)C(C)(C)C.[2H]C([2H])([2H])C([2H])(C)c1ccc2c(c1N(c1c(-c3ccccc3)cccc1C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])C(C)(C)C)C(C)(C)c1ccccc1-2.

What is the InChIKey of N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine?

The InChIKey is MDSQHAJDSZBFMS-ZHLLTNJZSA-N. The full InChI is InChI=1S/2C37H43N.C36H41N/c2*1-24(2)27-19-15-20-29(26-16-11-10-12-17-26)34(27)38(36(5,6)7)35-28(25(3)4)22-23-31-30-18-13-14-21-32(30)37(8,9)33(31)35;1-9-25-18-15-20-28(26-16-11-10-12-17-26)33(25)37(35(4,5)6)34-27(24(2)3)22-23-30-29-19-13-14-21-31(29)36(7,8)32(30)34/h2*10-25H,1-9H3;10-24H,9H2,1-8H3/i1D3,2D3,3D3,24D,25D;24D,25D;9D.

What are the key properties of N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine?

N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine has a molecular weight of 1505.33 g/mol, XLogP of 31.97, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-N-[2-(1-deuterioethyl)-6-phenylphenyl]-9,9-dimethyl-2-propan-2-ylfluoren-1-amine;N-tert-butyl-2-(2-deuteriopropan-2-yl)-N-[2-(2-deuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethylfluoren-1-amine;N-tert-butyl-N-[2-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)-6-phenylphenyl]-9,9-dimethyl-2-(1,1,1,2-tetradeuteriopropan-2-yl)fluoren-1-amine is sourced from PubChem (CID 159537097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).