N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide

C24H30N4O4S — CID 20666014

IUPACN-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide
SMILESCC(CNC(=O)c1cc2cc(OCC3CCNCC3)ccc2[nH]1)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C24H30N4O4S/c1-17(28-33(30,31)21-5-3-2-4-6-21)15-26-24(29)23-14-19-13-20(7-8-22(19)27-23)32-16-18-9-11-25-12-10-18/h2-8,13-14,17-18,25,27-28H,9-12,15-16H2,1H3,(H,26,29)
InChIKeyGPJWRYHMJMEUCT-UHFFFAOYSA-N
MW470.60 g/mol
LogP2.64
Rot. Bonds9

About N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide

N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide (PubChem CID 20666014) has the molecular formula C24H30N4O4S and a molecular weight of 470.60 g/mol. Its IUPAC name is N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide
PubChem CID20666014
Molecular FormulaC24H30N4O4S
Molecular Weight470.60 g/mol
Exact Mass470.20
IUPAC NameN-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide
SMILESCC(CNC(=O)c1cc2cc(OCC3CCNCC3)ccc2[nH]1)NS(=O)(=O)c1ccccc1
InChIInChI=1S/C24H30N4O4S/c1-17(28-33(30,31)21-5-3-2-4-6-21)15-26-24(29)23-14-19-13-20(7-8-22(19)27-23)32-16-18-9-11-25-12-10-18/h2-8,13-14,17-18,25,27-28H,9-12,15-16H2,1H3,(H,26,29)
InChIKeyGPJWRYHMJMEUCT-UHFFFAOYSA-N
XLogP2.64
TPSA112.32 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.60
LogP ≤ 52.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide with MolForge

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Related Compounds

Asp-9521
CID 25210792
2,3,4,9-Tetrahydro-6-methoxy-1H-pyrido(3,4-b)indol-1-one
CID 87372
L-756568
CID 9805998
N-(1-Isopropylpiperidin-4-YL)-1-(3-methoxybenzyl)-1H-indole-2-carboxamide
CID 6540267
Piperazine, 1-((5-methoxyindol-2-yl)carbonyl)-4-methyl-
CID 206876
3-{5-[2-(4-acetylpiperazin-1-yl)ethoxy]-1H-indol-2-yl}-1,2-dihydroquinolin-2-one
CID 5329373
4-({2-[2-(1-benzofuran-2-yl)-1H-indol-3-yl]ethyl}sulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 24825416
4-({2-[2-(1-benzofuran-2-yl)-1H-indol-3-yl]ethyl}sulfamoyl)-N-butylbenzamide
CID 24825417
4-({2-[2-(1-benzofuran-2-yl)-1H-indol-3-yl]ethyl}sulfamoyl)-N-cyclohexylbenzamide
CID 24825418
4-({2-[2-(1-benzofuran-2-yl)-1H-indol-3-yl]ethyl}sulfamoyl)-N-(2-hydroxyethyl)-N-methylbenzamide
CID 24825419
4-({2-[2-(1-benzofuran-2-yl)-1H-indol-3-yl]ethyl}sulfamoyl)-N-[2-(dimethylamino)ethyl]-N-methylbenzamide
CID 24825420
3-[3-(4-Chloranyl-3,5-Dimethyl-Phenoxy)propyl]-~{n}-(Phenylsulfonyl)-1~{h}-Indole-2-Carboxamide
CID 90083030

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide?
The IUPAC name of N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide (CID 20666014) is N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide.
What is the SMILES notation for N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide?
The canonical SMILES for N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide is CC(CNC(=O)c1cc2cc(OCC3CCNCC3)ccc2[nH]1)NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide?
The InChIKey is GPJWRYHMJMEUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O4S/c1-17(28-33(30,31)21-5-3-2-4-6-21)15-26-24(29)23-14-19-13-20(7-8-22(19)27-23)32-16-18-9-11-25-12-10-18/h2-8,13-14,17-18,25,27-28H,9-12,15-16H2,1H3,(H,26,29).
What are the key properties of N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide?
N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide has a molecular weight of 470.60 g/mol, XLogP of 2.64, 9 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzenesulfonamido)propyl]-5-(piperidin-4-ylmethoxy)-1H-indole-2-carboxamide is sourced from PubChem (CID 20666014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).