N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide

C18H20N4O3S — CID 53063425

IUPACN-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)cc1S(=O)(=O)NCCn1cnc2ccccc21
InChIInChI=1S/C18H20N4O3S/c1-13-7-8-16(21-14(2)23)18(11-13)26(24,25)20-9-10-22-12-19-15-5-3-4-6-17(15)22/h3-8,11-12,20H,9-10H2,1-2H3,(H,21,23)
InChIKeyFCOGXGZFWJBLPA-UHFFFAOYSA-N
MW372.45 g/mol
LogP2.28
Rot. Bonds6

About N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide

N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide (PubChem CID 53063425) has the molecular formula C18H20N4O3S and a molecular weight of 372.45 g/mol. Its IUPAC name is N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide
PubChem CID53063425
Molecular FormulaC18H20N4O3S
Molecular Weight372.45 g/mol
Exact Mass372.13
IUPAC NameN-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)cc1S(=O)(=O)NCCn1cnc2ccccc21
InChIInChI=1S/C18H20N4O3S/c1-13-7-8-16(21-14(2)23)18(11-13)26(24,25)20-9-10-22-12-19-15-5-3-4-6-17(15)22/h3-8,11-12,20H,9-10H2,1-2H3,(H,21,23)
InChIKeyFCOGXGZFWJBLPA-UHFFFAOYSA-N
XLogP2.28
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide?
The IUPAC name of N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide (CID 53063425) is N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide.
What is the SMILES notation for N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide?
The canonical SMILES for N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide is CC(=O)Nc1ccc(C)cc1S(=O)(=O)NCCn1cnc2ccccc21.
What is the InChIKey of N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide?
The InChIKey is FCOGXGZFWJBLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3S/c1-13-7-8-16(21-14(2)23)18(11-13)26(24,25)20-9-10-22-12-19-15-5-3-4-6-17(15)22/h3-8,11-12,20H,9-10H2,1-2H3,(H,21,23).
What are the key properties of N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide?
N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide has a molecular weight of 372.45 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(benzimidazol-1-yl)ethylsulfamoyl]-4-methylphenyl]acetamide is sourced from PubChem (CID 53063425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).