4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide

C20H30N2O3S — CID 55662861

IUPAC4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1
InChIInChI=1S/C20H30N2O3S/c1-13(2)18-11-4-14(3)12-19(18)21-20(23)15-5-9-17(10-6-15)26(24,25)22-16-7-8-16/h5-6,9-10,13-14,16,18-19,22H,4,7-8,11-12H2,1-3H3,(H,21,23)
InChIKeyZZATZCREGJOOPU-UHFFFAOYSA-N
MW378.54 g/mol
LogP3.32
Rot. Bonds6

About 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide

4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide (PubChem CID 55662861) has the molecular formula C20H30N2O3S and a molecular weight of 378.54 g/mol. Its IUPAC name is 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
PubChem CID55662861
Molecular FormulaC20H30N2O3S
Molecular Weight378.54 g/mol
Exact Mass378.20
IUPAC Name4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
SMILESCC1CCC(C(C)C)C(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1
InChIInChI=1S/C20H30N2O3S/c1-13(2)18-11-4-14(3)12-19(18)21-20(23)15-5-9-17(10-6-15)26(24,25)22-16-7-8-16/h5-6,9-10,13-14,16,18-19,22H,4,7-8,11-12H2,1-3H3,(H,21,23)
InChIKeyZZATZCREGJOOPU-UHFFFAOYSA-N
XLogP3.32
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.54
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl]-4-phenylbenzamide
CID 126621339
4-methyl-N-[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]benzenesulfonamide
CID 164677819
N-(5-methyl-2-propan-2-ylcyclohexyl)benzenesulfonamide
CID 42960041
N-(5-methyl-2-propan-2-ylcyclohexyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47234721
4-(cyclopropylsulfamoyl)-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120576685
N-cyclopropyl-4-(2-methylpropanoyl)benzenesulfonamide
CID 82164865
4-[[(2R)-butan-2-yl]sulfamoyl]-N-(4-methylcyclohexyl)benzamide
CID 39032121
ethyl 4-[(3-methylcyclopentyl)sulfamoyl]benzoate
CID 114545305
N-(4-methylcyclohexyl)-4-propan-2-ylsulfonylbenzamide
CID 46485032
2,6-dichloro-N-[(1R,2S,5S)-5-methyl-2-propan-2-ylcyclohexyl]benzamide
CID 6932663
2-amino-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide
CID 61214396
5-bromo-N-(5-methyl-2-propan-2-ylcyclohexyl)pyridine-3-carboxamide
CID 63526340

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The IUPAC name of 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide (CID 55662861) is 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide.
What is the SMILES notation for 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The canonical SMILES for 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide is CC1CCC(C(C)C)C(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1.
What is the InChIKey of 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
The InChIKey is ZZATZCREGJOOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3S/c1-13(2)18-11-4-14(3)12-19(18)21-20(23)15-5-9-17(10-6-15)26(24,25)22-16-7-8-16/h5-6,9-10,13-14,16,18-19,22H,4,7-8,11-12H2,1-3H3,(H,21,23).
What are the key properties of 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide?
4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide has a molecular weight of 378.54 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylsulfamoyl)-N-(5-methyl-2-propan-2-ylcyclohexyl)benzamide is sourced from PubChem (CID 55662861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).