N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane

C92H140N12 — CID 163666398

About N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane

N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane (PubChem CID 163666398) has the molecular formula C92H140N12 and a molecular weight of 1414.22 g/mol. Its IUPAC name is N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane.

Molecular Properties

• Compound Name: N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane
• PubChem CID: 163666398
• Molecular Formula: C92H140N12
• Molecular Weight: 1414.22 g/mol
• Exact Mass: 1413.13
• IUPAC Name: N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane
• SMILES: CC.CC.CC.CC.CN(C)Cc1cc(CN(C)CN(C)C)c2c(c1)-c1ccccc1C2.CN(C)Cc1cc(CN(C)CN(C)C)cc2c1-c1ccccc1C2.CN(C)Cc1cc(CN(C)CN(C)C)cc2c1Cc1ccccc1-2.CN(C)Cc1cc2c(c(CN(C)CN(C)C)c1)-c1ccccc1C2
• InChI: InChI=1S/4C21H29N3.4C2H6/c1-22(2)14-18-10-16(13-24(5)15-23(3)4)11-21-19-9-7-6-8-17(19)12-20(18)21;1-22(2)13-16-10-18(14-24(5)15-23(3)4)20-12-17-8-6-7-9-19(17)21(20)11-16;1-22(2)14-19-11-16(13-24(5)15-23(3)4)10-18-12-17-8-6-7-9-20(17)21(18)19;1-22(2)13-16-10-18-12-17-8-6-7-9-20(17)21(18)19(11-16)14-24(5)15-23(3)4;4*1-2/h4*6-11H,12-15H2,1-5H3;4*1-2H3
• InChIKey: IYVXBASBTRUHSN-UHFFFAOYSA-N
• XLogP: 17.19
• TPSA: 38.88 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 24
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1414.22
LogP ≤ 5	17.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane?

The IUPAC name of N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane (CID 163666398) is N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane.

What is the SMILES notation for N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane?

The canonical SMILES for N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane is CC.CC.CC.CC.CN(C)Cc1cc(CN(C)CN(C)C)c2c(c1)-c1ccccc1C2.CN(C)Cc1cc(CN(C)CN(C)C)cc2c1-c1ccccc1C2.CN(C)Cc1cc(CN(C)CN(C)C)cc2c1Cc1ccccc1-2.CN(C)Cc1cc2c(c(CN(C)CN(C)C)c1)-c1ccccc1C2.

What is the InChIKey of N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane?

The InChIKey is IYVXBASBTRUHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/4C21H29N3.4C2H6/c1-22(2)14-18-10-16(13-24(5)15-23(3)4)11-21-19-9-7-6-8-17(19)12-20(18)21;1-22(2)13-16-10-18(14-24(5)15-23(3)4)20-12-17-8-6-7-9-19(17)21(20)11-16;1-22(2)14-19-11-16(13-24(5)15-23(3)4)10-18-12-17-8-6-7-9-20(17)21(18)19;1-22(2)13-16-10-18-12-17-8-6-7-9-20(17)21(18)19(11-16)14-24(5)15-23(3)4;4*1-2/h4*6-11H,12-15H2,1-5H3;4*1-2H3.

What are the key properties of N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane?

N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane has a molecular weight of 1414.22 g/mol, XLogP of 17.19, 24 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[[1-[(dimethylamino)methyl]-9H-fluoren-3-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[2-[(dimethylamino)methyl]-9H-fluoren-4-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[3-[(dimethylamino)methyl]-9H-fluoren-1-yl]methyl]-N,N,N'-trimethylmethanediamine;N'-[[4-[(dimethylamino)methyl]-9H-fluoren-2-yl]methyl]-N,N,N'-trimethylmethanediamine;ethane is sourced from PubChem (CID 163666398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).