1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate

C131H126F4N10O15 — CID 159766243

IUPAC1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate
SMILESCC(=O)c1ccc(Oc2ccc(F)c(C)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)cc2)cc1.CCOC(=O)Cn1ccc(-c2ccc(-c3ccc(OC)c(CC)c3)cc2)n1.CCc1cc(-c2ccc(-c3ccn(CC(=O)NCc4cccnc4)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccn(CC(=O)OC)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccnn3C)cc2)ccc1OC
InChIInChI=1S/C26H26N4O2.C22H24N2O3.C21H22N2O3.C19H20N2O.C15H13FO2.C14H10F2O2.C14H11FO2/c1-3-20-15-23(10-11-25(20)32-2)21-6-8-22(9-7-21)24-12-14-30(29-24)18-26(31)28-17-19-5-4-13-27-16-19;1-4-16-14-19(10-11-21(16)26-3)17-6-8-18(9-7-17)20-12-13-24(23-20)15-22(25)27-5-2;1-4-15-13-18(9-10-20(15)25-2)16-5-7-17(8-6-16)19-11-12-23(22-19)14-21(24)26-3;1-4-14-13-17(9-10-19(14)22-3)15-5-7-16(8-6-15)18-11-12-20-21(18)2;1-10-9-14(7-8-15(10)16)18-13-5-3-12(4-6-13)11(2)17;1-9(17)10-2-4-11(5-3-10)18-12-6-7-13(15)14(16)8-12;1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h4-16H,3,17-18H2,1-2H3,(H,28,31);6-14H,4-5,15H2,1-3H3;5-13H,4,14H2,1-3H3;5-13H,4H2,1-3H3;3-9H,1-2H3;2-8H,1H3;2-9H,1H3
InChIKeyNFNNMNXDZQKHFE-UHFFFAOYSA-N
MW2156.50 g/mol
LogP29.05
Rot. Bonds34

About 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate

1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate (PubChem CID 159766243) has the molecular formula C131H126F4N10O15 and a molecular weight of 2156.50 g/mol. Its IUPAC name is 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate.

Molecular Properties

Compound Name1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate
PubChem CID159766243
Molecular FormulaC131H126F4N10O15
Molecular Weight2156.50 g/mol
Exact Mass2154.93
IUPAC Name1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate
SMILESCC(=O)c1ccc(Oc2ccc(F)c(C)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)cc2)cc1.CCOC(=O)Cn1ccc(-c2ccc(-c3ccc(OC)c(CC)c3)cc2)n1.CCc1cc(-c2ccc(-c3ccn(CC(=O)NCc4cccnc4)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccn(CC(=O)OC)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccnn3C)cc2)ccc1OC
InChIInChI=1S/C26H26N4O2.C22H24N2O3.C21H22N2O3.C19H20N2O.C15H13FO2.C14H10F2O2.C14H11FO2/c1-3-20-15-23(10-11-25(20)32-2)21-6-8-22(9-7-21)24-12-14-30(29-24)18-26(31)28-17-19-5-4-13-27-16-19;1-4-16-14-19(10-11-21(16)26-3)17-6-8-18(9-7-17)20-12-13-24(23-20)15-22(25)27-5-2;1-4-15-13-18(9-10-20(15)25-2)16-5-7-17(8-6-16)19-11-12-23(22-19)14-21(24)26-3;1-4-14-13-17(9-10-19(14)22-3)15-5-7-16(8-6-15)18-11-12-20-21(18)2;1-10-9-14(7-8-15(10)16)18-13-5-3-12(4-6-13)11(2)17;1-9(17)10-2-4-11(5-3-10)18-12-6-7-13(15)14(16)8-12;1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h4-16H,3,17-18H2,1-2H3,(H,28,31);6-14H,4-5,15H2,1-3H3;5-13H,4,14H2,1-3H3;5-13H,4H2,1-3H3;3-9H,1-2H3;2-8H,1H3;2-9H,1H3
InChIKeyNFNNMNXDZQKHFE-UHFFFAOYSA-N
XLogP29.05
TPSA281.69 Ų
H-Bond Donors1
H-Bond Acceptors24
Rotatable Bonds34
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002156.50
LogP ≤ 529.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1024

Analyze 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate with MolForge

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Related Compounds

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N-[2-[3-(4-fluorophenyl)-5-pyridin-3-ylpyrazol-1-yl]ethyl]-2-(2-methoxyphenyl)acetamide
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3-(4-fluorophenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrazole-5-carboxamide
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2-(5-acetyl-2-methoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
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2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(pyridin-3-ylmethyl)acetamide
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5-(3,4-difluorophenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide
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ethyl N-[2-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]triazol-4-yl]carbamate
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2-(2-methoxy-5-propan-2-ylphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110767628
6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
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1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrazole-5-carboxamide
CID 42755274
2-(4-fluorophenoxy)-N-[[6-(2-methylpyrazol-3-yl)-3-pyridinyl]methyl]acetamide
CID 121023422

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate?
The IUPAC name of 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate (CID 159766243) is 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate.
What is the SMILES notation for 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate?
The canonical SMILES for 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate is CC(=O)c1ccc(Oc2ccc(F)c(C)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1.CC(=O)c1ccc(Oc2ccc(F)cc2)cc1.CCOC(=O)Cn1ccc(-c2ccc(-c3ccc(OC)c(CC)c3)cc2)n1.CCc1cc(-c2ccc(-c3ccn(CC(=O)NCc4cccnc4)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccn(CC(=O)OC)n3)cc2)ccc1OC.CCc1cc(-c2ccc(-c3ccnn3C)cc2)ccc1OC.
What is the InChIKey of 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate?
The InChIKey is NFNNMNXDZQKHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O2.C22H24N2O3.C21H22N2O3.C19H20N2O.C15H13FO2.C14H10F2O2.C14H11FO2/c1-3-20-15-23(10-11-25(20)32-2)21-6-8-22(9-7-21)24-12-14-30(29-24)18-26(31)28-17-19-5-4-13-27-16-19;1-4-16-14-19(10-11-21(16)26-3)17-6-8-18(9-7-17)20-12-13-24(23-20)15-22(25)27-5-2;1-4-15-13-18(9-10-20(15)25-2)16-5-7-17(8-6-16)19-11-12-23(22-19)14-21(24)26-3;1-4-14-13-17(9-10-19(14)22-3)15-5-7-16(8-6-15)18-11-12-20-21(18)2;1-10-9-14(7-8-15(10)16)18-13-5-3-12(4-6-13)11(2)17;1-9(17)10-2-4-11(5-3-10)18-12-6-7-13(15)14(16)8-12;1-10(16)11-2-6-13(7-3-11)17-14-8-4-12(15)5-9-14/h4-16H,3,17-18H2,1-2H3,(H,28,31);6-14H,4-5,15H2,1-3H3;5-13H,4,14H2,1-3H3;5-13H,4H2,1-3H3;3-9H,1-2H3;2-8H,1H3;2-9H,1H3.
What are the key properties of 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate?
1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate has a molecular weight of 2156.50 g/mol, XLogP of 29.05, 34 rotatable bonds, 1 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3,4-difluorophenoxy)phenyl]ethanone;ethyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate;5-[4-(3-ethyl-4-methoxyphenyl)phenyl]-1-methylpyrazole;2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]-N-(pyridin-3-ylmethyl)acetamide;1-[4-(4-fluoro-3-methylphenoxy)phenyl]ethanone;1-[4-(4-fluorophenoxy)phenyl]ethanone;methyl 2-[3-[4-(3-ethyl-4-methoxyphenyl)phenyl]pyrazol-1-yl]acetate is sourced from PubChem (CID 159766243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).