2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide

C129H117ClF4N18O23S7 — CID 161271491

IUPAC2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide
SMILESCC(c1ccccc1)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.CC(c1ccccc1F)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.COc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1OC.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccc(C)cn3)c2)cc1.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1C(F)(F)F.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1Cl
InChIInChI=1S/C19H15F3N2O3S.C19H19N3O3S.C19H18N2O5S.C18H15ClN2O3S.C18H16FN3O3S.2C18H17N3O3S/c1-13-5-6-15(11-16(13)19(20,21)22)28(26,27)24-9-7-14(12-24)10-18(25)17-4-2-3-8-23-17;1-14-3-6-16(7-4-14)13-26(24,25)22-10-9-17(12-22)21-19(23)18-8-5-15(2)11-20-18;1-25-18-7-6-15(12-19(18)26-2)27(23,24)21-10-8-14(13-21)11-17(22)16-5-3-4-9-20-16;1-13-5-6-15(11-16(13)19)25(23,24)21-9-7-14(12-21)10-18(22)17-4-2-3-8-20-17;1-13(15-6-2-3-7-16(15)19)26(24,25)22-11-9-14(12-22)21-18(23)17-8-4-5-10-20-17;1-14-5-7-15(8-6-14)13-25(23,24)21-11-9-16(12-21)20-18(22)17-4-2-3-10-19-17;1-14(15-7-3-2-4-8-15)25(23,24)21-12-10-16(13-21)20-18(22)17-9-5-6-11-19-17/h2-9,11-12H,10H2,1H3;3-12H,13H2,1-2H3,(H,21,23);3-10,12-13H,11H2,1-2H3;2-9,11-12H,10H2,1H3;2-13H,1H3,(H,21,23);2-12H,13H2,1H3,(H,20,22);2-14H,1H3,(H,20,22)
InChIKeyVDWLMLIYUZWIJR-UHFFFAOYSA-N
MW2623.37 g/mol
LogP22.18
Rot. Bonds37

About 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide

2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide (PubChem CID 161271491) has the molecular formula C129H117ClF4N18O23S7 and a molecular weight of 2623.37 g/mol. Its IUPAC name is 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide
PubChem CID161271491
Molecular FormulaC129H117ClF4N18O23S7
Molecular Weight2623.37 g/mol
Exact Mass2620.62
IUPAC Name2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide
SMILESCC(c1ccccc1)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.CC(c1ccccc1F)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.COc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1OC.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccc(C)cn3)c2)cc1.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1C(F)(F)F.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1Cl
InChIInChI=1S/C19H15F3N2O3S.C19H19N3O3S.C19H18N2O5S.C18H15ClN2O3S.C18H16FN3O3S.2C18H17N3O3S/c1-13-5-6-15(11-16(13)19(20,21)22)28(26,27)24-9-7-14(12-24)10-18(25)17-4-2-3-8-23-17;1-14-3-6-16(7-4-14)13-26(24,25)22-10-9-17(12-22)21-19(23)18-8-5-15(2)11-20-18;1-25-18-7-6-15(12-19(18)26-2)27(23,24)21-10-8-14(13-21)11-17(22)16-5-3-4-9-20-16;1-13-5-6-15(11-16(13)19)25(23,24)21-9-7-14(12-21)10-18(22)17-4-2-3-8-20-17;1-13(15-6-2-3-7-16(15)19)26(24,25)22-11-9-14(12-22)21-18(23)17-8-4-5-10-20-17;1-14-5-7-15(8-6-14)13-25(23,24)21-11-9-16(12-21)20-18(22)17-4-2-3-10-19-17;1-14(15-7-3-2-4-8-15)25(23,24)21-12-10-16(13-21)20-18(22)17-9-5-6-11-19-17/h2-9,11-12H,10H2,1H3;3-12H,13H2,1-2H3,(H,21,23);3-10,12-13H,11H2,1-2H3;2-9,11-12H,10H2,1H3;2-13H,1H3,(H,21,23);2-12H,13H2,1H3,(H,20,22);2-14H,1H3,(H,20,22)
InChIKeyVDWLMLIYUZWIJR-UHFFFAOYSA-N
XLogP22.18
TPSA549.79 Ų
H-Bond Donors4
H-Bond Acceptors37
Rotatable Bonds37
Heavy Atoms182
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002623.37
LogP ≤ 522.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1037

Analyze 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide?
The IUPAC name of 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide (CID 161271491) is 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide.
What is the SMILES notation for 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide?
The canonical SMILES for 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide is CC(c1ccccc1)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.CC(c1ccccc1F)S(=O)(=O)n1ccc(NC(=O)c2ccccn2)c1.COc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1OC.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccc(C)cn3)c2)cc1.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1C(F)(F)F.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3ccccn3)c2)cc1Cl.
What is the InChIKey of 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide?
The InChIKey is VDWLMLIYUZWIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N2O3S.C19H19N3O3S.C19H18N2O5S.C18H15ClN2O3S.C18H16FN3O3S.2C18H17N3O3S/c1-13-5-6-15(11-16(13)19(20,21)22)28(26,27)24-9-7-14(12-24)10-18(25)17-4-2-3-8-23-17;1-14-3-6-16(7-4-14)13-26(24,25)22-10-9-17(12-22)21-19(23)18-8-5-15(2)11-20-18;1-25-18-7-6-15(12-19(18)26-2)27(23,24)21-10-8-14(13-21)11-17(22)16-5-3-4-9-20-16;1-13-5-6-15(11-16(13)19)25(23,24)21-9-7-14(12-21)10-18(22)17-4-2-3-8-20-17;1-13(15-6-2-3-7-16(15)19)26(24,25)22-11-9-14(12-22)21-18(23)17-8-4-5-10-20-17;1-14-5-7-15(8-6-14)13-25(23,24)21-11-9-16(12-21)20-18(22)17-4-2-3-10-19-17;1-14(15-7-3-2-4-8-15)25(23,24)21-12-10-16(13-21)20-18(22)17-9-5-6-11-19-17/h2-9,11-12H,10H2,1H3;3-12H,13H2,1-2H3,(H,21,23);3-10,12-13H,11H2,1-2H3;2-9,11-12H,10H2,1H3;2-13H,1H3,(H,21,23);2-12H,13H2,1H3,(H,20,22);2-14H,1H3,(H,20,22).
What are the key properties of 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide?
2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide has a molecular weight of 2623.37 g/mol, XLogP of 22.18, 37 rotatable bonds, 4 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-chloro-4-methylphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-[1-(2-fluorophenyl)ethylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;5-methyl-N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-[4-methyl-3-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]-1-pyridin-2-ylethanone;N-[1-(1-phenylethylsulfonyl)pyrrol-3-yl]pyridine-2-carboxamide is sourced from PubChem (CID 161271491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).