4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline

C112H100F22N18 — CID 158474060

IUPAC4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline
SMILESCc1cc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c(F)c1.Cc1ccc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c1F.Cc1cccc(F)c1CNc1ccc(-c2cn(C(F)F)nc2C)cc1.Cc1ccccc1CNc1ccc(-c2cn(C(F)F)nc2C)c(F)c1.Cc1nn(C(F)F)cc1-c1ccc(NCc2c(F)cccc2F)cc1.Cc1nn(C(F)F)cc1-c1ccc(NCc2ccccc2F)cc1F
InChIInChI=1S/2C19H17F4N3.2C19H18F3N3.2C18H15F4N3/c1-11-3-8-17(20)15(18(11)21)9-24-14-6-4-13(5-7-14)16-10-26(19(22)23)25-12(16)2;1-11-7-17(20)15(18(21)8-11)9-24-14-5-3-13(4-6-14)16-10-26(19(22)23)25-12(16)2;1-12-4-3-5-18(20)16(12)10-23-15-8-6-14(7-9-15)17-11-25(19(21)22)24-13(17)2;1-12-5-3-4-6-14(12)10-23-15-7-8-16(18(20)9-15)17-11-25(19(21)22)24-13(17)2;1-11-15(10-25(24-11)18(21)22)12-5-7-13(8-6-12)23-9-14-16(19)3-2-4-17(14)20;1-11-15(10-25(24-11)18(21)22)14-7-6-13(8-17(14)20)23-9-12-4-2-3-5-16(12)19/h2*3-8,10,19,24H,9H2,1-2H3;2*3-9,11,19,23H,10H2,1-2H3;2*2-8,10,18,23H,9H2,1H3
InChIKeyHGSDLNIYBREPCH-UHFFFAOYSA-N
MW2116.11 g/mol
LogP31.82
Rot. Bonds30

About 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline

4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline (PubChem CID 158474060) has the molecular formula C112H100F22N18 and a molecular weight of 2116.11 g/mol. Its IUPAC name is 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline.

Molecular Properties

Compound Name4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline
PubChem CID158474060
Molecular FormulaC112H100F22N18
Molecular Weight2116.11 g/mol
Exact Mass2114.80
IUPAC Name4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline
SMILESCc1cc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c(F)c1.Cc1ccc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c1F.Cc1cccc(F)c1CNc1ccc(-c2cn(C(F)F)nc2C)cc1.Cc1ccccc1CNc1ccc(-c2cn(C(F)F)nc2C)c(F)c1.Cc1nn(C(F)F)cc1-c1ccc(NCc2c(F)cccc2F)cc1.Cc1nn(C(F)F)cc1-c1ccc(NCc2ccccc2F)cc1F
InChIInChI=1S/2C19H17F4N3.2C19H18F3N3.2C18H15F4N3/c1-11-3-8-17(20)15(18(11)21)9-24-14-6-4-13(5-7-14)16-10-26(19(22)23)25-12(16)2;1-11-7-17(20)15(18(21)8-11)9-24-14-5-3-13(4-6-14)16-10-26(19(22)23)25-12(16)2;1-12-4-3-5-18(20)16(12)10-23-15-8-6-14(7-9-15)17-11-25(19(21)22)24-13(17)2;1-12-5-3-4-6-14(12)10-23-15-7-8-16(18(20)9-15)17-11-25(19(21)22)24-13(17)2;1-11-15(10-25(24-11)18(21)22)12-5-7-13(8-6-12)23-9-14-16(19)3-2-4-17(14)20;1-11-15(10-25(24-11)18(21)22)14-7-6-13(8-17(14)20)23-9-12-4-2-3-5-16(12)19/h2*3-8,10,19,24H,9H2,1-2H3;2*3-9,11,19,23H,10H2,1-2H3;2*2-8,10,18,23H,9H2,1H3
InChIKeyHGSDLNIYBREPCH-UHFFFAOYSA-N
XLogP31.82
TPSA179.10 Ų
H-Bond Donors6
H-Bond Acceptors18
Rotatable Bonds30
Heavy Atoms152
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002116.11
LogP ≤ 531.82
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1018

Analyze 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline with MolForge

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Related Compounds

N-[[2-fluoro-5-(1-methylpyrazol-3-yl)-4-(trifluoromethyl)phenyl]methyl]-1-methyl-3-phenylpyrazol-4-amine
CID 123576010
5,10,15,20-Tetrakis[3-(4-fluorophenyl)-1-(4-methylphenyl)pyrazol-4-yl]-21,23-dihydroporphyrin
CID 142756942
3-(3-tert-butyl-2-methylphenyl)-1-(2,2-difluoropropyl)pyrazole;3-(3-tert-butyl-2-methylphenyl)-1-(2,2-dimethylpropyl)pyrazole;5-(3-tert-butyl-2-methylphenyl)-1-methyl-4H-pyrazol-1-ium;3-(3-tert-butyl-2-methylphenyl)-1-propylpyrazole
CID 157218474
1-(2-Tert-butyl-4-fluorophenyl)pyrazole;2-(2-tert-butyl-5-fluorophenyl)triazole;2-(2-tert-butyl-6-fluorophenyl)triazole;1-(2-tert-butyl-4-methylphenyl)pyrazole;1-(2-tert-butylphenyl)-3-methylpyrazole;1-(2-tert-butylphenyl)pyrazole;1-(3-tert-butylphenyl)pyrazole;1-(2-tert-butylphenyl)-3-(trifluoromethyl)pyrazole;2-[2-tert-butyl-6-(trifluoromethyl)phenyl]triazole
CID 157506191
copper;pentakis(3,5-bis(trifluoromethyl)pyrazol-1-ide);tetrakis(copper(1+));bis(N-[4-(3-isoquinolin-3-ylphenyl)phenyl]-4-methyl-N-(4-methylphenyl)aniline)
CID 157526811
N-(2-boranylidyneethyl)-4-(1-methylpyrazol-4-yl)-N-propan-2-ylaniline;6-fluoro-5-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;N-methyl-4-(1-methylpyrazol-4-yl)-N-propan-2-ylaniline;N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-propan-2-ylaniline;5-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;6-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;5-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-1-propan-2-yl-2,3-dihydroindole;1-propan-2-yl-2,3-dihydroindole;1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 157652299
3-(3-tert-butyl-2-methylphenyl)-1-(2,2-difluoropropyl)pyrazole;3-(3-tert-butyl-2-methylphenyl)-1-(2,2-dimethylpropyl)pyrazole;5-(3-tert-butyl-2-methylphenyl)-1-methyl-4H-pyrazol-1-ium;3-[3-(3-tert-butyl-2-methylphenyl)pyrazol-1-yl]propanenitrile;methane
CID 158415300
3-cyclopropyl-1-methyl-4-(4-propan-2-ylphenyl)pyrazole;1-cyclopropyl-4-(4-propan-2-ylphenyl)pyrazole;4-[2-(difluoromethyl)-5-fluoro-4-propan-2-ylphenyl]-1-methylpyrazole;4-[2-(difluoromethyl)-4-propan-2-ylphenyl]-1-methylpyrazole;4-(2,5-difluoro-4-propan-2-ylphenyl)-2-methyl-5-(trifluoromethyl)-1H-pyrazol-2-ium;1-ethyl-4-(4-propan-2-ylphenyl)pyrazole;4-fluoro-2-(1-methylpyrazol-4-yl)-5-propan-2-ylbenzonitrile;3-(4-propan-2-ylphenyl)benzonitrile;1-propan-2-yl-3-(trifluoromethyl)benzene
CID 158492183
4-Tert-butyl-1-methyl-2-[2-methyl-3-(2-methylpyrazol-2-ium-1-yl)phenyl]pyridin-1-ium;2-[4,6-difluoro-2-methyl-3-(2-methylpyrazol-2-ium-1-yl)phenyl]-1-methylpyridin-1-ium;1-methyl-2-[2-methyl-3-(2-methylpyrazol-2-ium-1-yl)phenyl]pyridin-1-ium;1-methyl-2-[2-methyl-3-(2-methylpyrazol-2-ium-1-yl)-5-(trifluoromethyl)phenyl]pyridin-1-ium;1-methyl-2-[2,4,6-trimethyl-3-(2-methylpyrazol-2-ium-1-yl)phenyl]pyridin-1-ium
CID 158855641
6-fluoro-5-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;N-methyl-4-(1-methylpyrazol-4-yl)-N-propan-2-ylaniline;3-methyl-5-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;N-methyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-propan-2-ylaniline;2-[4-(1-methylpyrazol-4-yl)-N-propan-2-ylanilino]acetonitrile;5-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;6-(1-methylpyrazol-4-yl)-1-propan-2-yl-2,3-dihydroindole;6-(1-methylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;5-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]-1-propan-2-yl-2,3-dihydroindole;1-propan-2-yl-2,3-dihydroindole;1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 158905777
1,2-ditert-butylbenzene;tetrakis(1,2-ditert-butyl-4-methylbenzene);hexakis(3,4-ditert-butyl-1-methylpyrazole);4,5-ditert-butyl-2H-pyrrole;1,2-ditert-butyl-4-(trifluoromethyl)benzene;methane;2,2,4,4-tetramethylpentane;2,3,4-trimethylpentane
CID 159032686
N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2,6-difluorobenzamide;bis(N-[2,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2,6-difluorobenzamide);N-[2,5-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2-fluoro-6-methylbenzamide;N-[4-(1,3-dimethylpyrazol-4-yl)-2,5-difluorophenyl]-2,6-difluorobenzamide;N-[4-(1,3-dimethylpyrazol-4-yl)-2,5-difluorophenyl]-2-fluorobenzamide
CID 159183784

Frequently Asked Questions

What is the IUPAC name of 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline?
The IUPAC name of 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline (CID 158474060) is 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline.
What is the SMILES notation for 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline?
The canonical SMILES for 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline is Cc1cc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c(F)c1.Cc1ccc(F)c(CNc2ccc(-c3cn(C(F)F)nc3C)cc2)c1F.Cc1cccc(F)c1CNc1ccc(-c2cn(C(F)F)nc2C)cc1.Cc1ccccc1CNc1ccc(-c2cn(C(F)F)nc2C)c(F)c1.Cc1nn(C(F)F)cc1-c1ccc(NCc2c(F)cccc2F)cc1.Cc1nn(C(F)F)cc1-c1ccc(NCc2ccccc2F)cc1F.
What is the InChIKey of 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline?
The InChIKey is HGSDLNIYBREPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H17F4N3.2C19H18F3N3.2C18H15F4N3/c1-11-3-8-17(20)15(18(11)21)9-24-14-6-4-13(5-7-14)16-10-26(19(22)23)25-12(16)2;1-11-7-17(20)15(18(21)8-11)9-24-14-5-3-13(4-6-14)16-10-26(19(22)23)25-12(16)2;1-12-4-3-5-18(20)16(12)10-23-15-8-6-14(7-9-15)17-11-25(19(21)22)24-13(17)2;1-12-5-3-4-6-14(12)10-23-15-7-8-16(18(20)9-15)17-11-25(19(21)22)24-13(17)2;1-11-15(10-25(24-11)18(21)22)12-5-7-13(8-6-12)23-9-14-16(19)3-2-4-17(14)20;1-11-15(10-25(24-11)18(21)22)14-7-6-13(8-17(14)20)23-9-12-4-2-3-5-16(12)19/h2*3-8,10,19,24H,9H2,1-2H3;2*3-9,11,19,23H,10H2,1-2H3;2*2-8,10,18,23H,9H2,1H3.
What are the key properties of 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline?
4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline has a molecular weight of 2116.11 g/mol, XLogP of 31.82, 30 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-3-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluoro-4-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2,6-difluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-fluorophenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-N-[(2-fluoro-6-methylphenyl)methyl]aniline;4-[1-(difluoromethyl)-3-methylpyrazol-4-yl]-3-fluoro-N-[(2-methylphenyl)methyl]aniline is sourced from PubChem (CID 158474060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).