N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide

C118H135N15O15S2 — CID 159953516

IUPACN-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide
SMILESCCN(CC1CCN(C2Cc3ccccc3C2)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1cccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1.COc1cccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1
InChIInChI=1S/C26H31N3O.2C24H27N3O3.2C22H25N3O4S/c1-2-28(26(30)25-17-22-9-5-6-10-24(22)27-25)18-19-11-13-29(14-12-19)23-15-20-7-3-4-8-21(20)16-23;1-30-20-7-4-5-18(13-20)14-23(28)27-11-9-17(10-12-27)16-25-24(29)22-15-19-6-2-3-8-21(19)26-22;1-30-20-8-6-17(7-9-20)14-23(28)27-12-10-18(11-13-27)16-25-24(29)22-15-19-4-2-3-5-21(19)26-22;1-29-18-6-4-7-19(14-18)30(27,28)25-11-9-16(10-12-25)15-23-22(26)21-13-17-5-2-3-8-20(17)24-21;1-29-18-6-8-19(9-7-18)30(27,28)25-12-10-16(11-13-25)15-23-22(26)21-14-17-4-2-3-5-20(17)24-21/h3-10,17,19,23,27H,2,11-16,18H2,1H3;2-8,13,15,17,26H,9-12,14,16H2,1H3,(H,25,29);2-9,15,18,26H,10-14,16H2,1H3,(H,25,29);2-8,13-14,16,24H,9-12,15H2,1H3,(H,23,26);2-9,14,16,24H,10-13,15H2,1H3,(H,23,26)
InChIKeyOCKNHDBRGRNLTH-UHFFFAOYSA-N
MW2067.60 g/mol
LogP17.30
Rot. Bonds29

About N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide

N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide (PubChem CID 159953516) has the molecular formula C118H135N15O15S2 and a molecular weight of 2067.60 g/mol. Its IUPAC name is N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide
PubChem CID159953516
Molecular FormulaC118H135N15O15S2
Molecular Weight2067.60 g/mol
Exact Mass2065.97
IUPAC NameN-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide
SMILESCCN(CC1CCN(C2Cc3ccccc3C2)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1cccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1.COc1cccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1
InChIInChI=1S/C26H31N3O.2C24H27N3O3.2C22H25N3O4S/c1-2-28(26(30)25-17-22-9-5-6-10-24(22)27-25)18-19-11-13-29(14-12-19)23-15-20-7-3-4-8-21(20)16-23;1-30-20-7-4-5-18(13-20)14-23(28)27-11-9-17(10-12-27)16-25-24(29)22-15-19-6-2-3-8-21(19)26-22;1-30-20-8-6-17(7-9-20)14-23(28)27-12-10-18(11-13-27)16-25-24(29)22-15-19-4-2-3-5-21(19)26-22;1-29-18-6-4-7-19(14-18)30(27,28)25-11-9-16(10-12-25)15-23-22(26)21-13-17-5-2-3-8-20(17)24-21;1-29-18-6-8-19(9-7-18)30(27,28)25-12-10-16(11-13-25)15-23-22(26)21-14-17-4-2-3-5-20(17)24-21/h3-10,17,19,23,27H,2,11-16,18H2,1H3;2-8,13,15,17,26H,9-12,14,16H2,1H3,(H,25,29);2-9,15,18,26H,10-14,16H2,1H3,(H,25,29);2-8,13-14,16,24H,9-12,15H2,1H3,(H,23,26);2-9,14,16,24H,10-13,15H2,1H3,(H,23,26)
InChIKeyOCKNHDBRGRNLTH-UHFFFAOYSA-N
XLogP17.30
TPSA371.20 Ų
H-Bond Donors9
H-Bond Acceptors16
Rotatable Bonds29
Heavy Atoms150
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002067.60
LogP ≤ 517.30
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1016

Analyze N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide (CID 159953516) is N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide is CCN(CC1CCN(C2Cc3ccccc3C2)CC1)C(=O)c1cc2ccccc2[nH]1.COc1ccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1ccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1.COc1cccc(CC(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1.COc1cccc(S(=O)(=O)N2CCC(CNC(=O)c3cc4ccccc4[nH]3)CC2)c1.
What is the InChIKey of N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide?
The InChIKey is OCKNHDBRGRNLTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H31N3O.2C24H27N3O3.2C22H25N3O4S/c1-2-28(26(30)25-17-22-9-5-6-10-24(22)27-25)18-19-11-13-29(14-12-19)23-15-20-7-3-4-8-21(20)16-23;1-30-20-7-4-5-18(13-20)14-23(28)27-11-9-17(10-12-27)16-25-24(29)22-15-19-6-2-3-8-21(19)26-22;1-30-20-8-6-17(7-9-20)14-23(28)27-12-10-18(11-13-27)16-25-24(29)22-15-19-4-2-3-5-21(19)26-22;1-29-18-6-4-7-19(14-18)30(27,28)25-11-9-16(10-12-25)15-23-22(26)21-13-17-5-2-3-8-20(17)24-21;1-29-18-6-8-19(9-7-18)30(27,28)25-12-10-16(11-13-25)15-23-22(26)21-14-17-4-2-3-5-20(17)24-21/h3-10,17,19,23,27H,2,11-16,18H2,1H3;2-8,13,15,17,26H,9-12,14,16H2,1H3,(H,25,29);2-9,15,18,26H,10-14,16H2,1H3,(H,25,29);2-8,13-14,16,24H,9-12,15H2,1H3,(H,23,26);2-9,14,16,24H,10-13,15H2,1H3,(H,23,26).
What are the key properties of N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide?
N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide has a molecular weight of 2067.60 g/mol, XLogP of 17.30, 29 rotatable bonds, 9 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-[2-(4-methoxyphenyl)acetyl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(3-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 159953516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).