N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline

C132H166F33N13O7 — CID 158854964

About N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline

N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline (PubChem CID 158854964) has the molecular formula C132H166F33N13O7 and a molecular weight of 2673.80 g/mol. Its IUPAC name is N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline.

Molecular Properties

• Compound Name: N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline
• PubChem CID: 158854964
• Molecular Formula: C132H166F33N13O7
• Molecular Weight: 2673.80 g/mol
• Exact Mass: 2672.25
• IUPAC Name: N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline
• SMILES: CCN(CC)c1ccc(C(F)(F)F)cc1C.CNCCOc1ccc(C(F)(F)F)cc1C.Cc1cc(C(F)(F)F)ccc1N(C)C.Cc1cc(C(F)(F)F)ccc1N1CCCC1.Cc1cc(C(F)(F)F)ccc1N1CCNCC1.Cc1cc(C(F)(F)F)ccc1OC1CCNCC1.Cc1cc(C(F)(F)F)ccc1OC1CCNCC1.Cc1cc(C(F)(F)F)ccc1OCC(C)(C)N.Cc1cc(C(F)(F)F)ccc1OCC1CCCN1.Cc1cc(C(F)(F)F)ccc1OCCN.Cc1cc(C(F)(F)F)ccc1OCCN1CCNCC1
• InChI: InChI=1S/C14H19F3N2O.3C13H16F3NO.C12H15F3N2.C12H16F3NO.C12H14F3N.C12H16F3N.C11H14F3NO.C10H12F3NO.C10H12F3N/c1-11-10-12(14(15,16)17)2-3-13(11)20-9-8-19-6-4-18-5-7-19;2*1-9-8-10(13(14,15)16)2-3-12(9)18-11-4-6-17-7-5-11;1-9-7-10(13(14,15)16)4-5-12(9)18-8-11-3-2-6-17-11;1-9-8-10(12(13,14)15)2-3-11(9)17-6-4-16-5-7-17;1-8-6-9(12(13,14)15)4-5-10(8)17-7-11(2,3)16;1-9-8-10(12(13,14)15)4-5-11(9)16-6-2-3-7-16;1-4-16(5-2)11-7-6-10(8-9(11)3)12(13,14)15;1-8-7-9(11(12,13)14)3-4-10(8)16-6-5-15-2;1-7-6-8(10(11,12)13)2-3-9(7)15-5-4-14;1-7-6-8(10(11,12)13)4-5-9(7)14(2)3/h2-3,10,18H,4-9H2,1H3;2*2-3,8,11,17H,4-7H2,1H3;4-5,7,11,17H,2-3,6,8H2,1H3;2-3,8,16H,4-7H2,1H3;4-6H,7,16H2,1-3H3;4-5,8H,2-3,6-7H2,1H3;6-8H,4-5H2,1-3H3;3-4,7,15H,5-6H2,1-2H3;2-3,6H,4-5,14H2,1H3;4-6H,1-3H3
• InChIKey: IZXWMXPDFRQIPI-UHFFFAOYSA-N
• XLogP: 32.80
• TPSA: 205.03 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 27
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2673.80
LogP ≤ 5	32.80
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline?

The IUPAC name of N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline (CID 158854964) is N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline.

What is the SMILES notation for N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline?

The canonical SMILES for N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline is CCN(CC)c1ccc(C(F)(F)F)cc1C.CNCCOc1ccc(C(F)(F)F)cc1C.Cc1cc(C(F)(F)F)ccc1N(C)C.Cc1cc(C(F)(F)F)ccc1N1CCCC1.Cc1cc(C(F)(F)F)ccc1N1CCNCC1.Cc1cc(C(F)(F)F)ccc1OC1CCNCC1.Cc1cc(C(F)(F)F)ccc1OC1CCNCC1.Cc1cc(C(F)(F)F)ccc1OCC(C)(C)N.Cc1cc(C(F)(F)F)ccc1OCC1CCCN1.Cc1cc(C(F)(F)F)ccc1OCCN.Cc1cc(C(F)(F)F)ccc1OCCN1CCNCC1.

What is the InChIKey of N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline?

The InChIKey is IZXWMXPDFRQIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O.3C13H16F3NO.C12H15F3N2.C12H16F3NO.C12H14F3N.C12H16F3N.C11H14F3NO.C10H12F3NO.C10H12F3N/c1-11-10-12(14(15,16)17)2-3-13(11)20-9-8-19-6-4-18-5-7-19;2*1-9-8-10(13(14,15)16)2-3-12(9)18-11-4-6-17-7-5-11;1-9-7-10(13(14,15)16)4-5-12(9)18-8-11-3-2-6-17-11;1-9-8-10(12(13,14)15)2-3-11(9)17-6-4-16-5-7-17;1-8-6-9(12(13,14)15)4-5-10(8)17-7-11(2,3)16;1-9-8-10(12(13,14)15)4-5-11(9)16-6-2-3-7-16;1-4-16(5-2)11-7-6-10(8-9(11)3)12(13,14)15;1-8-7-9(11(12,13)14)3-4-10(8)16-6-5-15-2;1-7-6-8(10(11,12)13)2-3-9(7)15-5-4-14;1-7-6-8(10(11,12)13)4-5-9(7)14(2)3/h2-3,10,18H,4-9H2,1H3;2*2-3,8,11,17H,4-7H2,1H3;4-5,7,11,17H,2-3,6,8H2,1H3;2-3,8,16H,4-7H2,1H3;4-6H,7,16H2,1-3H3;4-5,8H,2-3,6-7H2,1H3;6-8H,4-5H2,1-3H3;3-4,7,15H,5-6H2,1-2H3;2-3,6H,4-5,14H2,1H3;4-6H,1-3H3.

What are the key properties of N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline?

N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline has a molecular weight of 2673.80 g/mol, XLogP of 32.80, 27 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diethyl-2-methyl-4-(trifluoromethyl)aniline;N-methyl-2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;2-methyl-1-[2-methyl-4-(trifluoromethyl)phenoxy]propan-2-amine;2-[2-methyl-4-(trifluoromethyl)phenoxy]ethanamine;1-[2-[2-methyl-4-(trifluoromethyl)phenoxy]ethyl]piperazine;2-[[2-methyl-4-(trifluoromethyl)phenoxy]methyl]pyrrolidine;bis(4-[2-methyl-4-(trifluoromethyl)phenoxy]piperidine);1-[2-methyl-4-(trifluoromethyl)phenyl]piperazine;1-[2-methyl-4-(trifluoromethyl)phenyl]pyrrolidine;N,N,2-trimethyl-4-(trifluoromethyl)aniline is sourced from PubChem (CID 158854964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).