N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide

C17H23N3O3S — CID 71932055

IUPACN-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C17H23N3O3S/c21-17(10-14-12-19-16-7-2-1-6-15(14)16)18-8-9-24(22,23)20-11-13-4-3-5-13/h1-2,6-7,12-13,19-20H,3-5,8-11H2,(H,18,21)
InChIKeyIHPJZBCGXKBFBO-UHFFFAOYSA-N
MW349.46 g/mol
LogP1.55
Rot. Bonds8

About N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide

N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 71932055) has the molecular formula C17H23N3O3S and a molecular weight of 349.46 g/mol. Its IUPAC name is N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide
PubChem CID71932055
Molecular FormulaC17H23N3O3S
Molecular Weight349.46 g/mol
Exact Mass349.15
IUPAC NameN-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C17H23N3O3S/c21-17(10-14-12-19-16-7-2-1-6-15(14)16)18-8-9-24(22,23)20-11-13-4-3-5-13/h1-2,6-7,12-13,19-20H,3-5,8-11H2,(H,18,21)
InChIKeyIHPJZBCGXKBFBO-UHFFFAOYSA-N
XLogP1.55
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(cyclohexylmethylamino)ethyl]-3-(1H-indol-3-yl)propanamide
CID 68709397
1-cyclobutyl-N-(1H-indol-3-ylmethyl)methanamine
CID 62332415
2-(1H-indol-3-yl)-N-[(2-methylcyclopentyl)methyl]acetamide
CID 107420241
N-cyclopentyloxy-2-(1H-indol-3-yl)acetamide
CID 83202752
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N-(cyclohexylmethyl)-3-(1H-indol-3-yl)-2-oxopropanamide
CID 91562917
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425
N-(3-benzylsulfonylpropyl)-2-(1H-indol-3-yl)acetamide
CID 47029588
2-(1H-indol-3-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 30385068
methyl 3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate
CID 2539049
N-[2-(cyclopentylamino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112990882
2-(1H-indol-3-yl)-N-(oxan-2-ylmethyl)acetamide
CID 47406454

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide (CID 71932055) is N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccccc12)NCCS(=O)(=O)NCC1CCC1.
What is the InChIKey of N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is IHPJZBCGXKBFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3S/c21-17(10-14-12-19-16-7-2-1-6-15(14)16)18-8-9-24(22,23)20-11-13-4-3-5-13/h1-2,6-7,12-13,19-20H,3-5,8-11H2,(H,18,21).
What are the key properties of N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide?
N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 349.46 g/mol, XLogP of 1.55, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclobutylmethylsulfamoyl)ethyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 71932055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).