4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide

C17H20N4O3S — CID 70785168

IUPAC4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide
SMILESO=C(NCCc1cnccn1)c1ccc(S(=O)(=O)NC2CCC2)cc1
InChIInChI=1S/C17H20N4O3S/c22-17(20-9-8-15-12-18-10-11-19-15)13-4-6-16(7-5-13)25(23,24)21-14-2-1-3-14/h4-7,10-12,14,21H,1-3,8-9H2,(H,20,22)
InChIKeyULUOUTJMYQVOMW-UHFFFAOYSA-N
MW360.44 g/mol
LogP1.28
Rot. Bonds7

About 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide

4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide (PubChem CID 70785168) has the molecular formula C17H20N4O3S and a molecular weight of 360.44 g/mol. Its IUPAC name is 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide.

Molecular Properties

Compound Name4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide
PubChem CID70785168
Molecular FormulaC17H20N4O3S
Molecular Weight360.44 g/mol
Exact Mass360.13
IUPAC Name4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide
SMILESO=C(NCCc1cnccn1)c1ccc(S(=O)(=O)NC2CCC2)cc1
InChIInChI=1S/C17H20N4O3S/c22-17(20-9-8-15-12-18-10-11-19-15)13-4-6-16(7-5-13)25(23,24)21-14-2-1-3-14/h4-7,10-12,14,21H,1-3,8-9H2,(H,20,22)
InChIKeyULUOUTJMYQVOMW-UHFFFAOYSA-N
XLogP1.28
TPSA101.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide?
The IUPAC name of 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide (CID 70785168) is 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide.
What is the SMILES notation for 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide?
The canonical SMILES for 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide is O=C(NCCc1cnccn1)c1ccc(S(=O)(=O)NC2CCC2)cc1.
What is the InChIKey of 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide?
The InChIKey is ULUOUTJMYQVOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3S/c22-17(20-9-8-15-12-18-10-11-19-15)13-4-6-16(7-5-13)25(23,24)21-14-2-1-3-14/h4-7,10-12,14,21H,1-3,8-9H2,(H,20,22).
What are the key properties of 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide?
4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide has a molecular weight of 360.44 g/mol, XLogP of 1.28, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylsulfamoyl)-N-(2-pyrazin-2-ylethyl)benzamide is sourced from PubChem (CID 70785168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).