5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

C14H20N2O3S — CID 51233854

IUPAC5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NC(C)C
InChIInChI=1S/C14H20N2O3S/c1-9(2)15-14(17)13-8-12(7-4-10(13)3)20(18,19)16-11-5-6-11/h4,7-9,11,16H,5-6H2,1-3H3,(H,15,17)
InChIKeyNDWNFKSWJQPTAO-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.57
Rot. Bonds5

About 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide

5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (PubChem CID 51233854) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
PubChem CID51233854
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NC(C)C
InChIInChI=1S/C14H20N2O3S/c1-9(2)15-14(17)13-8-12(7-4-10(13)3)20(18,19)16-11-5-6-11/h4,7-9,11,16H,5-6H2,1-3H3,(H,15,17)
InChIKeyNDWNFKSWJQPTAO-UHFFFAOYSA-N
XLogP1.57
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[5-(cyclopropylsulfamoyl)-2-methylbenzoyl]amino]-4-methylpentanoic acid
CID 119187975
N-(1-amino-4-methylpentan-2-yl)-5-(cyclopropylsulfamoyl)-2-methylbenzamide;hydrochloride
CID 119586889
5-(cyclopropylsulfamoyl)-N-[1-(2-methoxyphenyl)ethyl]-2-methylbenzamide
CID 18131994
N-[cyclopropyl(phenyl)methyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 42890157
5-(cyclopropylsulfamoyl)-2-methyl-N-[1-(4-methylphenyl)propyl]benzamide
CID 55489119
5-(ethylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 27648413
5-(tert-butylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide
CID 6463060
5-(cyclopropylsulfamoyl)-2-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 46679817
5-(cyclopropylsulfamoyl)-2-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 35804827
[2-(3-methylbutan-2-ylamino)-2-oxoethyl] 5-(cyclopropylsulfamoyl)-2-methylbenzoate
CID 46679220
5-(cyclohexylsulfamoyl)-2-methyl-N-[(2S)-2-phenylpropyl]benzamide
CID 9301857
N-[4-(cyclopropanecarbonylamino)phenyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide
CID 24613986

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide (CID 51233854) is 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide.
What is the SMILES notation for 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The canonical SMILES for 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NC(C)C.
What is the InChIKey of 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
The InChIKey is NDWNFKSWJQPTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-9(2)15-14(17)13-8-12(7-4-10(13)3)20(18,19)16-11-5-6-11/h4,7-9,11,16H,5-6H2,1-3H3,(H,15,17).
What are the key properties of 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide?
5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide has a molecular weight of 296.39 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoyl)-2-methyl-N-propan-2-ylbenzamide is sourced from PubChem (CID 51233854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).