N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide

C19H22N2O4S — CID 51160928

IUPACN-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(NCc1ccccc1)c1cccc(S(=O)(=O)NCC2CCCO2)c1
InChIInChI=1S/C19H22N2O4S/c22-19(20-13-15-6-2-1-3-7-15)16-8-4-10-18(12-16)26(23,24)21-14-17-9-5-11-25-17/h1-4,6-8,10,12,17,21H,5,9,11,13-14H2,(H,20,22)
InChIKeyMADQCZXWMKPPTF-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.07
Rot. Bonds7

About N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide

N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide (PubChem CID 51160928) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
PubChem CID51160928
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
SMILESO=C(NCc1ccccc1)c1cccc(S(=O)(=O)NCC2CCCO2)c1
InChIInChI=1S/C19H22N2O4S/c22-19(20-13-15-6-2-1-3-7-15)16-8-4-10-18(12-16)26(23,24)21-14-17-9-5-11-25-17/h1-4,6-8,10,12,17,21H,5,9,11,13-14H2,(H,20,22)
InChIKeyMADQCZXWMKPPTF-UHFFFAOYSA-N
XLogP2.07
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-methylphenyl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 74632236
N-[(4-acetamidophenyl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 18207149
N-[3-[benzyl(methyl)amino]propyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 43045382
N-[(6-methoxynaphthalen-2-yl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 24646084
N-[(4-benzylmorpholin-2-yl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 55526641
N-[(2,4-dimethylphenyl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 75871785
N-[(4-bromothiophen-2-yl)methyl]-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 55867907
N-(oxolan-2-ylmethyl)-3-(phenylsulfamoyl)benzamide
CID 19257393
4-(oxolan-2-ylmethylsulfamoyl)-N-[(3-phenoxyphenyl)methyl]benzamide
CID 46468515
N-tert-butyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 109063903
N-[(3-chlorophenyl)methyl]-4-[[(2S)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 9165383
N,N-dimethyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 42910274

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide (CID 51160928) is N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide is O=C(NCc1ccccc1)c1cccc(S(=O)(=O)NCC2CCCO2)c1.
What is the InChIKey of N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide?
The InChIKey is MADQCZXWMKPPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c22-19(20-13-15-6-2-1-3-7-15)16-8-4-10-18(12-16)26(23,24)21-14-17-9-5-11-25-17/h1-4,6-8,10,12,17,21H,5,9,11,13-14H2,(H,20,22).
What are the key properties of N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide?
N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide has a molecular weight of 374.46 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(oxolan-2-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 51160928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).