3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide

C20H21N3O3S — CID 30867031

IUPAC3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C20H21N3O3S/c24-20(21-11-10-15-13-22-19-7-2-1-6-18(15)19)14-4-3-5-17(12-14)27(25,26)23-16-8-9-16/h1-7,12-13,16,22-23H,8-11H2,(H,21,24)
InChIKeyMSTDKWPVSVKLSP-UHFFFAOYSA-N
MW383.47 g/mol
LogP2.58
Rot. Bonds7

About 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide

3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide (PubChem CID 30867031) has the molecular formula C20H21N3O3S and a molecular weight of 383.47 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
PubChem CID30867031
Molecular FormulaC20H21N3O3S
Molecular Weight383.47 g/mol
Exact Mass383.13
IUPAC Name3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C20H21N3O3S/c24-20(21-11-10-15-13-22-19-7-2-1-6-18(15)19)14-4-3-5-17(12-14)27(25,26)23-16-8-9-16/h1-7,12-13,16,22-23H,8-11H2,(H,21,24)
InChIKeyMSTDKWPVSVKLSP-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

3-(tert-butylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645056
N-[2-(1H-indol-3-yl)ethyl]-3-(prop-2-ynylsulfamoyl)benzamide
CID 27009969
N-butyl-3-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
CID 109062575
N-[2-(1H-indol-3-yl)ethyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 27645730
3-[4-(cyclopropylsulfamoyl)phenyl]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 55570240
3-chloro-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 787235
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-tert-butyl-3-[2-(1H-indol-3-yl)ethylsulfamoyl]benzamide
CID 109065045
3-(carbamoylamino)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 26245340
1-N-[2-(1H-indol-3-yl)ethyl]-3-N-(2-methoxyethyl)benzene-1,3-dicarboxamide
CID 109052528
2-(cyclopropylamino)-N-[2-(1H-indol-3-yl)ethyl]pyrimidine-5-carboxamide
CID 109247506
N-[2-(1H-indol-3-yl)ethyl]-3-(methoxymethyl)benzamide
CID 51200340

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide (CID 30867031) is 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is O=C(NCCc1c[nH]c2ccccc12)c1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide?
The InChIKey is MSTDKWPVSVKLSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3S/c24-20(21-11-10-15-13-22-19-7-2-1-6-18(15)19)14-4-3-5-17(12-14)27(25,26)23-16-8-9-16/h1-7,12-13,16,22-23H,8-11H2,(H,21,24).
What are the key properties of 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide?
3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]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 3-(cyclopropylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide is sourced from PubChem (CID 30867031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).