3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide

C19H22N2O3S — CID 42236607

IUPAC3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide
SMILESCC(C)c1cccc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H22N2O3S/c1-13(2)14-5-3-7-17(11-14)20-19(22)15-6-4-8-18(12-15)25(23,24)21-16-9-10-16/h3-8,11-13,16,21H,9-10H2,1-2H3,(H,20,22)
InChIKeyUWIVFABPXJDRSU-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.50
Rot. Bonds6

About 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide

3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide (PubChem CID 42236607) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide
PubChem CID42236607
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide
SMILESCC(C)c1cccc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H22N2O3S/c1-13(2)14-5-3-7-17(11-14)20-19(22)15-6-4-8-18(12-15)25(23,24)21-16-9-10-16/h3-8,11-13,16,21H,9-10H2,1-2H3,(H,20,22)
InChIKeyUWIVFABPXJDRSU-UHFFFAOYSA-N
XLogP3.50
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197
N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide
CID 17404523
3-[[3-(cyclohexylsulfamoyl)benzoyl]amino]benzoic acid
CID 1121769
3-(cyclopropylsulfamoyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 32624601
3-(cyclopropylsulfamoyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 26718017
N-[3-(cyclopropylsulfamoyl)phenyl]-4-sulfamoylbenzamide
CID 24646340
3-(cyclopropylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
CID 30858539
(2R)-2-amino-N-[3-(cyclopropylsulfamoyl)phenyl]propanamide
CID 54995716
N-(5-acetamido-2-chlorophenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 39851862
S-[4-[[3-(cyclopropylsulfamoyl)benzoyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56529932
3-(cyclopropylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
CID 46570374
methyl 2-[3-[[3-(cyclopropylsulfamoyl)phenyl]carbamoyl]phenoxy]acetate
CID 55871864

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide (CID 42236607) is 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide is CC(C)c1cccc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide?
The InChIKey is UWIVFABPXJDRSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-13(2)14-5-3-7-17(11-14)20-19(22)15-6-4-8-18(12-15)25(23,24)21-16-9-10-16/h3-8,11-13,16,21H,9-10H2,1-2H3,(H,20,22).
What are the key properties of 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide?
3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide has a molecular weight of 358.46 g/mol, XLogP of 3.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-N-(3-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 42236607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).