N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide

C20H26N2O3S — CID 109062830

IUPACN-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide
SMILESCC(C)CNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C20H26N2O3S/c1-14(2)13-21-20(23)16-8-7-9-17(12-16)26(24,25)22-19-11-6-5-10-18(19)15(3)4/h5-12,14-15,22H,13H2,1-4H3,(H,21,23)
InChIKeyYGAXFRUYLPYCJZ-UHFFFAOYSA-N
MW374.51 g/mol
LogP4.00
Rot. Bonds7

About N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide

N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide (PubChem CID 109062830) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide
PubChem CID109062830
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide
SMILESCC(C)CNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C20H26N2O3S/c1-14(2)13-21-20(23)16-8-7-9-17(12-16)26(24,25)22-19-11-6-5-10-18(19)15(3)4/h5-12,14-15,22H,13H2,1-4H3,(H,21,23)
InChIKeyYGAXFRUYLPYCJZ-UHFFFAOYSA-N
XLogP4.00
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765
3-[(2,3-dimethylphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 109062826
N-(2-propan-2-ylphenyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 17438081
3-[(2-chlorophenyl)sulfamoyl]-N-[(2S)-2-hydroxy-3-methylbutyl]benzamide
CID 97012345
N-[(2R)-2-(ethylamino)propyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 120653897
3-(3-methylbutylsulfamoyl)-N-(2-propan-2-ylphenyl)benzamide
CID 109065280
N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109063672
N-(2-methylphenyl)-3-(2-methylpropylsulfamoyl)benzamide
CID 109062702
3-[(4-fluorophenyl)methylsulfamoyl]-N-(2-methylpropyl)benzamide
CID 109062787
3-(methylsulfamoyl)-N-[2-(2-propan-2-ylphenoxy)ethyl]benzamide
CID 99116231
3-methyl-N-(2-methylpropyl)benzamide
CID 835315
N-[2-(3-chlorophenyl)-2-hydroxyethyl]-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 51114512

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide (CID 109062830) is N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide is CC(C)CNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide?
The InChIKey is YGAXFRUYLPYCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-14(2)13-21-20(23)16-8-7-9-17(12-16)26(24,25)22-19-11-6-5-10-18(19)15(3)4/h5-12,14-15,22H,13H2,1-4H3,(H,21,23).
What are the key properties of N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide?
N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide has a molecular weight of 374.51 g/mol, XLogP of 4.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 109062830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).