N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide

C20H21N3O3S — CID 109058300

IUPACN-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
SMILESO=C(NC1CC1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C20H21N3O3S/c24-20(23-16-7-8-16)14-5-9-17(10-6-14)27(25,26)22-12-11-15-13-21-19-4-2-1-3-18(15)19/h1-6,9-10,13,16,21-22H,7-8,11-12H2,(H,23,24)
InChIKeyUKLCNEJGFLXGDJ-UHFFFAOYSA-N
MW383.47 g/mol
LogP2.58
Rot. Bonds7

About N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide

N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide (PubChem CID 109058300) has the molecular formula C20H21N3O3S and a molecular weight of 383.47 g/mol. Its IUPAC name is N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
PubChem CID109058300
Molecular FormulaC20H21N3O3S
Molecular Weight383.47 g/mol
Exact Mass383.13
IUPAC NameN-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
SMILESO=C(NC1CC1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C20H21N3O3S/c24-20(23-16-7-8-16)14-5-9-17(10-6-14)27(25,26)22-12-11-15-13-21-19-4-2-1-3-18(15)19/h1-6,9-10,13,16,21-22H,7-8,11-12H2,(H,23,24)
InChIKeyUKLCNEJGFLXGDJ-UHFFFAOYSA-N
XLogP2.58
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 52.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(1H-indol-3-yl)ethylsulfamoyl]-N-phenylbenzamide
CID 58615628
4-(bromomethyl)-N-[2-(1H-indol-3-yl)ethyl]benzenesulfonamide
CID 2737664
N-cyclopropyl-2-[2-(1H-indol-3-yl)ethylamino]pyrimidine-5-carboxamide
CID 109247309
4-(cyclopropanecarbonyl)-N-(1H-indol-3-ylmethyl)benzenesulfonamide
CID 110406911
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 30867031
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 55570240
3-(benzenesulfonamido)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 27644763
3-[(4-fluorophenyl)sulfonylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 18107802
N-[2-(1H-indol-3-yl)ethyl]cyclopropanesulfonamide
CID 113250435
N-cyclopropyl-5-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109223605
4-[cyclohexyl(methyl)sulfamoyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645778

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide?
The IUPAC name of N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide (CID 109058300) is N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide is O=C(NC1CC1)c1ccc(S(=O)(=O)NCCc2c[nH]c3ccccc23)cc1.
What is the InChIKey of N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide?
The InChIKey is UKLCNEJGFLXGDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3S/c24-20(23-16-7-8-16)14-5-9-17(10-6-14)27(25,26)22-12-11-15-13-21-19-4-2-1-3-18(15)19/h1-6,9-10,13,16,21-22H,7-8,11-12H2,(H,23,24).
What are the key properties of N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide?
N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide has a molecular weight of 383.47 g/mol, XLogP of 2.58, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide is sourced from PubChem (CID 109058300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).