N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide

C20H24N2O3S — CID 40819169

IUPACN-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C20H24N2O3S/c1-3-14(2)18-6-4-5-7-19(18)21-20(23)15-8-12-17(13-9-15)26(24,25)22-16-10-11-16/h4-9,12-14,16,22H,3,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1
InChIKeyPVBXKAOUOICXRC-CQSZACIVSA-N
MW372.49 g/mol
LogP3.89
Rot. Bonds7

About N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide

N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide (PubChem CID 40819169) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
PubChem CID40819169
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide
SMILESCC[C@@H](C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C20H24N2O3S/c1-3-14(2)18-6-4-5-7-19(18)21-20(23)15-8-12-17(13-9-15)26(24,25)22-16-10-11-16/h4-9,12-14,16,22H,3,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1
InChIKeyPVBXKAOUOICXRC-CQSZACIVSA-N
XLogP3.89
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(cyclopropylsulfamoyl)-N-(2-methylsulfanylphenyl)benzamide
CID 46533931
N-[2-[(2R)-butan-2-yl]phenyl]benzamide
CID 849169
N-(2-butoxyphenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 55953705
4-(2-methylpropylsulfamoyl)-N-(2-propan-2-ylphenyl)benzamide
CID 109058952
4-(cyclopropylsulfamoyl)-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 35203522
4-(cyclopropylsulfamoyl)-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 109058403
[4-[[2-[(2R)-butan-2-yl]phenyl]carbamoyl]phenyl] acetate
CID 41121356
N-(2-butan-2-ylphenyl)-4-(2-sulfamoylphenyl)benzamide
CID 142083128
N-[2-[(2S)-butan-2-yl]phenyl]-4-(2-methylpropoxy)benzamide
CID 959904
4-(cyclopropylsulfamoyl)-N-[2-(diethylamino)propyl]benzamide
CID 46433043
N-(4-acetamidophenyl)-4-(cyclopropylsulfamoyl)benzamide
CID 30683390
4-(cyclopropylsulfamoyl)-N-(2-ethyl-6-methylphenyl)benzamide
CID 109058401

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide?
The IUPAC name of N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide (CID 40819169) is N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide.
What is the SMILES notation for N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide?
The canonical SMILES for N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide is CC[C@@H](C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide?
The InChIKey is PVBXKAOUOICXRC-CQSZACIVSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-3-14(2)18-6-4-5-7-19(18)21-20(23)15-8-12-17(13-9-15)26(24,25)22-16-10-11-16/h4-9,12-14,16,22H,3,10-11H2,1-2H3,(H,21,23)/t14-/m1/s1.
What are the key properties of N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide?
N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide has a molecular weight of 372.49 g/mol, XLogP of 3.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-butan-2-yl]phenyl]-4-(cyclopropylsulfamoyl)benzamide is sourced from PubChem (CID 40819169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).