N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline

C168H150F12N6 — CID 160725250

IUPACN-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline
SMILESCC(C)(C)N(c1ccccc1F)c1c(-c2ccccc2)ccc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccccc1.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)c(-c2ccccc2)cc1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1ccc(-c2ccccc2)c(-c2ccccc2)c1F
InChIInChI=1S/6C28H25F2N/c1-28(2,3)31(26-17-11-10-16-24(26)29)27-19-23(21-14-8-5-9-15-21)22(18-25(27)30)20-12-6-4-7-13-20;1-28(2,3)31(26-17-11-10-16-24(26)29)27-23(21-14-8-5-9-15-21)18-22(19-25(27)30)20-12-6-4-7-13-20;2*1-28(2,3)31(25-17-11-10-16-24(25)29)26-19-22(20-12-6-4-7-13-20)18-23(27(26)30)21-14-8-5-9-15-21;1-28(2,3)31(25-17-11-10-16-24(25)29)27-23(21-14-8-5-9-15-21)19-18-22(26(27)30)20-12-6-4-7-13-20;1-28(2,3)31(24-17-11-10-16-23(24)29)25-19-18-22(20-12-6-4-7-13-20)26(27(25)30)21-14-8-5-9-15-21/h6*4-19H,1-3H3
InChIKeyRTPVTGUUQFJSBC-UHFFFAOYSA-N
MW2481.07 g/mol
LogP49.41
Rot. Bonds24

About N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline

N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline (PubChem CID 160725250) has the molecular formula C168H150F12N6 and a molecular weight of 2481.07 g/mol. Its IUPAC name is N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline.

Molecular Properties

Compound NameN-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline
PubChem CID160725250
Molecular FormulaC168H150F12N6
Molecular Weight2481.07 g/mol
Exact Mass2479.17
IUPAC NameN-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline
SMILESCC(C)(C)N(c1ccccc1F)c1c(-c2ccccc2)ccc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccccc1.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)c(-c2ccccc2)cc1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1ccc(-c2ccccc2)c(-c2ccccc2)c1F
InChIInChI=1S/6C28H25F2N/c1-28(2,3)31(26-17-11-10-16-24(26)29)27-19-23(21-14-8-5-9-15-21)22(18-25(27)30)20-12-6-4-7-13-20;1-28(2,3)31(26-17-11-10-16-24(26)29)27-23(21-14-8-5-9-15-21)18-22(19-25(27)30)20-12-6-4-7-13-20;2*1-28(2,3)31(25-17-11-10-16-24(25)29)26-19-22(20-12-6-4-7-13-20)18-23(27(26)30)21-14-8-5-9-15-21;1-28(2,3)31(25-17-11-10-16-24(25)29)27-23(21-14-8-5-9-15-21)19-18-22(26(27)30)20-12-6-4-7-13-20;1-28(2,3)31(24-17-11-10-16-23(24)29)25-19-18-22(20-12-6-4-7-13-20)26(27(25)30)21-14-8-5-9-15-21/h6*4-19H,1-3H3
InChIKeyRTPVTGUUQFJSBC-UHFFFAOYSA-N
XLogP49.41
TPSA19.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds24
Heavy Atoms186
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002481.07
LogP ≤ 549.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline?
The IUPAC name of N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline (CID 160725250) is N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline.
What is the SMILES notation for N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline?
The canonical SMILES for N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline is CC(C)(C)N(c1ccccc1F)c1c(-c2ccccc2)ccc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1c(F)cc(-c2ccccc2)cc1-c1ccccc1.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)c(-c2ccccc2)cc1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1cc(-c2ccccc2)cc(-c2ccccc2)c1F.CC(C)(C)N(c1ccccc1F)c1ccc(-c2ccccc2)c(-c2ccccc2)c1F.
What is the InChIKey of N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline?
The InChIKey is RTPVTGUUQFJSBC-UHFFFAOYSA-N. The full InChI is InChI=1S/6C28H25F2N/c1-28(2,3)31(26-17-11-10-16-24(26)29)27-19-23(21-14-8-5-9-15-21)22(18-25(27)30)20-12-6-4-7-13-20;1-28(2,3)31(26-17-11-10-16-24(26)29)27-23(21-14-8-5-9-15-21)18-22(19-25(27)30)20-12-6-4-7-13-20;2*1-28(2,3)31(25-17-11-10-16-24(25)29)26-19-22(20-12-6-4-7-13-20)18-23(27(26)30)21-14-8-5-9-15-21;1-28(2,3)31(25-17-11-10-16-24(25)29)27-23(21-14-8-5-9-15-21)19-18-22(26(27)30)20-12-6-4-7-13-20;1-28(2,3)31(24-17-11-10-16-23(24)29)25-19-18-22(20-12-6-4-7-13-20)26(27(25)30)21-14-8-5-9-15-21/h6*4-19H,1-3H3.
What are the key properties of N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline?
N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline has a molecular weight of 2481.07 g/mol, XLogP of 49.41, 24 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,4-diphenylaniline;bis(N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,5-diphenylaniline);N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-3,6-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,5-diphenylaniline;N-tert-butyl-2-fluoro-N-(2-fluorophenyl)-4,6-diphenylaniline is sourced from PubChem (CID 160725250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).