5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium

C122H134N5+5 — CID 158916874

About 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium

5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium (PubChem CID 158916874) has the molecular formula C122H134N5+5 and a molecular weight of 1677.49 g/mol. Its IUPAC name is 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium.

Molecular Properties

• Compound Name: 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
• PubChem CID: 158916874
• Molecular Formula: C122H134N5+5
• Molecular Weight: 1677.49 g/mol
• Exact Mass: 1676.11
• IUPAC Name: 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
• SMILES: CCc1cc[n+](C)c(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)c1.CCc1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C(C)(C)c1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C([2H])(C)c1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C([2H])([2H])C([2H])(C)c1cc[n+](C)c(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)c1
• InChI: InChI=1S/2C25H28N.3C24H26N/c1-16(2)18-12-14-22(26(6)15-18)23-17(3)11-13-20-19-9-7-8-10-21(19)25(4,5)24(20)23;1-16(2)18-13-14-26(6)22(15-18)23-17(3)11-12-20-19-9-7-8-10-21(19)25(4,5)24(20)23;2*1-6-17-12-14-21(25(5)15-17)22-16(2)11-13-19-18-9-7-8-10-20(18)24(3,4)23(19)22;1-6-17-13-14-25(5)21(15-17)22-16(2)11-12-19-18-9-7-8-10-20(18)24(3,4)23(19)22/h2*7-16H,1-6H3;3*7-15H,6H2,1-5H3/q5*+1/i16D;1D3,16D;6D2
• InChIKey: WYOLWDFPBGCNFZ-UNXZCUBBSA-N
• XLogP: 27.90
• TPSA: 19.40 Ų
• Rotatable Bonds: 11
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1677.49
LogP ≤ 5	27.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium?

The IUPAC name of 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium (CID 158916874) is 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium.

What is the SMILES notation for 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium?

The canonical SMILES for 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium is CCc1cc[n+](C)c(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)c1.CCc1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C(C)(C)c1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C([2H])(C)c1ccc(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)[n+](C)c1.[2H]C([2H])([2H])C([2H])(C)c1cc[n+](C)c(-c2c(C)ccc3c2C(C)(C)c2ccccc2-3)c1.

What is the InChIKey of 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium?

The InChIKey is WYOLWDFPBGCNFZ-UNXZCUBBSA-N. The full InChI is InChI=1S/2C25H28N.3C24H26N/c1-16(2)18-12-14-22(26(6)15-18)23-17(3)11-13-20-19-9-7-8-10-21(19)25(4,5)24(20)23;1-16(2)18-13-14-26(6)22(15-18)23-17(3)11-12-20-19-9-7-8-10-21(19)25(4,5)24(20)23;2*1-6-17-12-14-21(25(5)15-17)22-16(2)11-13-19-18-9-7-8-10-20(18)24(3,4)23(19)22;1-6-17-13-14-25(5)21(15-17)22-16(2)11-12-19-18-9-7-8-10-20(18)24(3,4)23(19)22/h2*7-16H,1-6H3;3*7-15H,6H2,1-5H3/q5*+1/i16D;1D3,16D;6D2;;.

What are the key properties of 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium?

5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium has a molecular weight of 1677.49 g/mol, XLogP of 27.90, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(2-deuteriopropan-2-yl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-(1,1-dideuterioethyl)-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;4-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;5-ethyl-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium;1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium is sourced from PubChem (CID 158916874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).