About 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid
1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid (PubChem CID 167588592) has the molecular formula C94H98Cl2N12O9
and a molecular weight of 1610.80 g/mol. Its IUPAC name is 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid.
Analyze 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid with MolForge
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Frequently Asked Questions
What is the IUPAC name of 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid?
The IUPAC name of 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid (CID 167588592) is 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid.
What is the SMILES notation for 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid?
The canonical SMILES for 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid is Cc1c(C(=O)CN2CCC(O)CC2)c2ccccc2n1-c1ccc(Cl)cc1.O=C(CN1CCCC1)c1cn(-c2ccc(Cl)cc2)c2ccccc12.[C-]#[N+]c1ccc(-n2c(C)c(C(=O)CN3CCCCC3)c3nc(CCC(=O)O)ccc32)cc1.[C-]#[N+]c1ccc(-n2c(C)c(C(=O)CN3CCCCC3)c3nc(CCC(=O)OCC)ccc32)cc1.
What is the InChIKey of 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid?
The InChIKey is ICYSNDFOFMJOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N4O3.C25H26N4O3.C22H23ClN2O2.C20H19ClN2O/c1-4-34-25(33)15-11-21-10-14-23-27(29-21)26(24(32)18-30-16-6-5-7-17-30)19(2)31(23)22-12-8-20(28-3)9-13-22;1-17-24(22(30)16-28-14-4-3-5-15-28)25-21(12-8-19(27-25)9-13-23(31)32)29(17)20-10-6-18(26-2)7-11-20;1-15-22(21(27)14-24-12-10-18(26)11-13-24)19-4-2-3-5-20(19)25(15)17-8-6-16(23)7-9-17;21-15-7-9-16(10-8-15)23-13-18(17-5-1-2-6-19(17)23)20(24)14-22-11-3-4-12-22/h8-10,12-14H,4-7,11,15-18H2,1-2H3;6-8,10-12H,3-5,9,13-16H2,1H3,(H,31,32);2-9,18,26H,10-14H2,1H3;1-2,5-10,13H,3-4,11-12,14H2.
What are the key properties of 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid?
1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid has a molecular weight of 1610.80 g/mol, XLogP of 18.41, 23 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-chlorophenyl)indol-3-yl]-2-pyrrolidin-1-ylethanone;1-[1-(4-chlorophenyl)-2-methylindol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethanone;ethyl 3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoate;3-[1-(4-isocyanophenyl)-2-methyl-3-(2-piperidin-1-ylacetyl)pyrrolo[3,2-b]pyridin-5-yl]propanoic acid is sourced from PubChem (CID 167588592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).