N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide

C20H24N4O4S — CID 4843555

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)Cn2c(CO)nc3ccccc32)cc1
InChIInChI=1S/C20H24N4O4S/c1-3-23(4-2)29(27,28)16-11-9-15(10-12-16)21-20(26)13-24-18-8-6-5-7-17(18)22-19(24)14-25/h5-12,25H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKeyJFEUQCRFUTYWCG-UHFFFAOYSA-N
MW416.50 g/mol
LogP2.20
Rot. Bonds8

About N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide

N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide (PubChem CID 4843555) has the molecular formula C20H24N4O4S and a molecular weight of 416.50 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
PubChem CID4843555
Molecular FormulaC20H24N4O4S
Molecular Weight416.50 g/mol
Exact Mass416.15
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)Cn2c(CO)nc3ccccc32)cc1
InChIInChI=1S/C20H24N4O4S/c1-3-23(4-2)29(27,28)16-11-9-15(10-12-16)21-20(26)13-24-18-8-6-5-7-17(18)22-19(24)14-25/h5-12,25H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKeyJFEUQCRFUTYWCG-UHFFFAOYSA-N
XLogP2.20
TPSA104.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.50
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-2-(2-methylsulfanylbenzimidazol-1-yl)acetamide
CID 4883075
N-(4-tert-butylphenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 4566508
N-(4-ethoxyphenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 78767015
N-[4-(dimethylsulfamoyl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 26196060
2-[2-(hydroxymethyl)benzimidazol-1-yl]-N-(4-phenylmethoxyphenyl)acetamide
CID 99139728
N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 3460449
2-(2-ethylbenzimidazol-1-yl)-N-(3-methylsulfonylphenyl)acetamide
CID 27335104
N,N-diethyl-4-[[2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetyl]amino]benzamide
CID 17467311
4-(diethylsulfamoyl)-N-(1-propylbenzimidazol-2-yl)benzamide
CID 7408843
N-[6-(diethylamino)-3-pyridinyl]-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 55784403
N-(2-chlorophenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 4779873
2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]-N-methylacetamide
CID 1153553

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide (CID 4843555) is N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)Cn2c(CO)nc3ccccc32)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide?
The InChIKey is JFEUQCRFUTYWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O4S/c1-3-23(4-2)29(27,28)16-11-9-15(10-12-16)21-20(26)13-24-18-8-6-5-7-17(18)22-19(24)14-25/h5-12,25H,3-4,13-14H2,1-2H3,(H,21,26).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide has a molecular weight of 416.50 g/mol, XLogP of 2.20, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 4843555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).