3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine

C87H71ClF19N11 — CID 157494331

IUPAC3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
SMILESCC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1cccc(C(F)(F)F)c1.CC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1ccccc1.CNc1ccc(-c2cccnc2)nc1C(C)(F)F.Cc1ccc(-c2cncc(C(F)(F)F)c2)nc1C.Cc1cncc(-c2ccc(CCc3cccc(Cl)c3)c(C(F)(F)F)n2)c1
InChIInChI=1S/C21H15F7N2.C20H16ClF3N2.C20H16F4N2.C13H11F3N2.C13H13F2N3/c1-12(13-4-2-6-15(10-13)20(23,24)25)29-18-9-8-17(30-19(18)21(26,27)28)14-5-3-7-16(22)11-14;1-13-9-16(12-25-11-13)18-8-7-15(19(26-18)20(22,23)24)6-5-14-3-2-4-17(21)10-14;1-13(14-6-3-2-4-7-14)25-18-11-10-17(26-19(18)20(22,23)24)15-8-5-9-16(21)12-15;1-8-3-4-12(18-9(8)2)10-5-11(7-17-6-10)13(14,15)16;1-13(14,15)12-11(16-2)6-5-10(18-12)9-4-3-7-17-8-9/h2-12,29H,1H3;2-4,7-12H,5-6H2,1H3;2-13,25H,1H3;3-7H,1-2H3;3-8,16H,1-2H3
InChIKeyBXQLECXPAJLLCV-UHFFFAOYSA-N
MW1667.02 g/mol
LogP26.16
Rot. Bonds16

About 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine

3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine (PubChem CID 157494331) has the molecular formula C87H71ClF19N11 and a molecular weight of 1667.02 g/mol. Its IUPAC name is 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine.

Molecular Properties

Compound Name3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
PubChem CID157494331
Molecular FormulaC87H71ClF19N11
Molecular Weight1667.02 g/mol
Exact Mass1665.53
IUPAC Name3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine
SMILESCC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1cccc(C(F)(F)F)c1.CC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1ccccc1.CNc1ccc(-c2cccnc2)nc1C(C)(F)F.Cc1ccc(-c2cncc(C(F)(F)F)c2)nc1C.Cc1cncc(-c2ccc(CCc3cccc(Cl)c3)c(C(F)(F)F)n2)c1
InChIInChI=1S/C21H15F7N2.C20H16ClF3N2.C20H16F4N2.C13H11F3N2.C13H13F2N3/c1-12(13-4-2-6-15(10-13)20(23,24)25)29-18-9-8-17(30-19(18)21(26,27)28)14-5-3-7-16(22)11-14;1-13-9-16(12-25-11-13)18-8-7-15(19(26-18)20(22,23)24)6-5-14-3-2-4-17(21)10-14;1-13(14-6-3-2-4-7-14)25-18-11-10-17(26-19(18)20(22,23)24)15-8-5-9-16(21)12-15;1-8-3-4-12(18-9(8)2)10-5-11(7-17-6-10)13(14,15)16;1-13(14,15)12-11(16-2)6-5-10(18-12)9-4-3-7-17-8-9/h2-12,29H,1H3;2-4,7-12H,5-6H2,1H3;2-13,25H,1H3;3-7H,1-2H3;3-8,16H,1-2H3
InChIKeyBXQLECXPAJLLCV-UHFFFAOYSA-N
XLogP26.16
TPSA139.21 Ų
H-Bond Donors3
H-Bond Acceptors11
Rotatable Bonds16
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001667.02
LogP ≤ 526.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1011

Analyze 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine with MolForge

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Related Compounds

N-[(4-chlorophenyl)-pyridin-3-ylmethyl]-1-[6-(trifluoromethyl)-3-pyridinyl]piperidin-4-amine
CID 56665724
Bis(4-chloro-2-(4-chloro-2-pyridinyl)pyridine);ruthenium(2+);bis(tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide);dihydrate
CID 139238460
Tetrakis(4-chloro-2-(4-chloro-2-pyridinyl)pyridine);bis(chlororuthenium(1+));bis(tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide)
CID 139238461
1-(5-chloropyridin-2-yl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenyl-N-(pyridin-3-ylmethyl)ethanamine
CID 58921517
2-[1-[[4-[(3S)-3-aminopiperidin-1-yl]-3-pyridinyl]amino]prop-1-enyl]-6-(3-chloro-2-fluorophenyl)pyridin-3-amine
CID 89689234
N-[(2-chloro-4-pyridinyl)methyl]-4-fluoro-2-[1-[[4-(4-fluorophenyl)phenyl]methyl]piperidin-4-yl]-6-(trifluoromethyl)pyridin-3-amine
CID 90774642
N-[(2-chloro-4-pyridinyl)methyl]-6-(difluoromethyl)-2-[1-[[4-(4-fluorophenyl)phenyl]methyl]piperidin-4-yl]pyridin-3-amine
CID 90849986
N-[(3-chlorophenyl)methyl]-6-(5-fluoropyridin-3-yl)-2-(trifluoromethyl)pyridin-3-amine
CID 130473537
N-[(3-chlorophenyl)methyl]-2-(1,1-difluoroethyl)-6-(5-fluoropyridin-3-yl)pyridin-3-amine
CID 130473545
3-[4-[8-Chloro-3-[4-(5-fluoroisoquinolin-8-yl)piperidin-3-yl]isoquinolin-5-yl]piperidin-3-yl]-8-piperidin-4-yl-5-(trifluoromethyl)isoquinoline
CID 138572963
N-[(2-chloro-5-fluorophenyl)methyl]-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethanamine;N-[1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-3-phenylpropan-1-amine;ethane
CID 143473058
6-[3-(5-chloro-2-fluorophenyl)-3-iminoprop-1-en-2-yl]-N-methyl-N-(2-piperazin-1-ylethyl)-1,5-naphthyridin-3-amine
CID 153609188

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The IUPAC name of 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine (CID 157494331) is 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine.
What is the SMILES notation for 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The canonical SMILES for 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine is CC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1cccc(C(F)(F)F)c1.CC(Nc1ccc(-c2cccc(F)c2)nc1C(F)(F)F)c1ccccc1.CNc1ccc(-c2cccnc2)nc1C(C)(F)F.Cc1ccc(-c2cncc(C(F)(F)F)c2)nc1C.Cc1cncc(-c2ccc(CCc3cccc(Cl)c3)c(C(F)(F)F)n2)c1.
What is the InChIKey of 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
The InChIKey is BXQLECXPAJLLCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F7N2.C20H16ClF3N2.C20H16F4N2.C13H11F3N2.C13H13F2N3/c1-12(13-4-2-6-15(10-13)20(23,24)25)29-18-9-8-17(30-19(18)21(26,27)28)14-5-3-7-16(22)11-14;1-13-9-16(12-25-11-13)18-8-7-15(19(26-18)20(22,23)24)6-5-14-3-2-4-17(21)10-14;1-13(14-6-3-2-4-7-14)25-18-11-10-17(26-19(18)20(22,23)24)15-8-5-9-16(21)12-15;1-8-3-4-12(18-9(8)2)10-5-11(7-17-6-10)13(14,15)16;1-13(14,15)12-11(16-2)6-5-10(18-12)9-4-3-7-17-8-9/h2-12,29H,1H3;2-4,7-12H,5-6H2,1H3;2-13,25H,1H3;3-7H,1-2H3;3-8,16H,1-2H3.
What are the key properties of 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine?
3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine has a molecular weight of 1667.02 g/mol, XLogP of 26.16, 16 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-chlorophenyl)ethyl]-6-(5-methyl-3-pyridinyl)-2-(trifluoromethyl)pyridine;2-(1,1-difluoroethyl)-N-methyl-6-pyridin-3-ylpyridin-3-amine;2,3-dimethyl-6-[5-(trifluoromethyl)-3-pyridinyl]pyridine;6-(3-fluorophenyl)-N-(1-phenylethyl)-2-(trifluoromethyl)pyridin-3-amine;6-(3-fluorophenyl)-2-(trifluoromethyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-3-amine is sourced from PubChem (CID 157494331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).