4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide

C23H29N3O4S — CID 18513135

IUPAC4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NC(CCc2ccccc2)(C(N)=O)C2CCCCC2)cc1
InChIInChI=1S/C23H29N3O4S/c24-21(27)18-11-13-20(14-12-18)31(29,30)26-23(22(25)28,19-9-5-2-6-10-19)16-15-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19,26H,2,5-6,9-10,15-16H2,(H2,24,27)(H2,25,28)
InChIKeyRIOPLRFWYSDLFX-UHFFFAOYSA-N
MW443.57 g/mol
LogP2.50
Rot. Bonds9

About 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide

4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide (PubChem CID 18513135) has the molecular formula C23H29N3O4S and a molecular weight of 443.57 g/mol. Its IUPAC name is 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide
PubChem CID18513135
Molecular FormulaC23H29N3O4S
Molecular Weight443.57 g/mol
Exact Mass443.19
IUPAC Name4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NC(CCc2ccccc2)(C(N)=O)C2CCCCC2)cc1
InChIInChI=1S/C23H29N3O4S/c24-21(27)18-11-13-20(14-12-18)31(29,30)26-23(22(25)28,19-9-5-2-6-10-19)16-15-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19,26H,2,5-6,9-10,15-16H2,(H2,24,27)(H2,25,28)
InChIKeyRIOPLRFWYSDLFX-UHFFFAOYSA-N
XLogP2.50
TPSA132.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.57
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]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-[(1-amino-2-cyclohexyl-3,3-dimethyl-1-oxobutan-2-yl)sulfamoyl]benzamide
CID 18513134
4-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]sulfamoyl]benzamide
CID 107848473
4-[(1-amino-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide
CID 18513137
4-[(1-phenylcyclohexyl)methylsulfamoyl]benzamide
CID 46457755
4-(2-phenylethyl)benzamide
CID 23130460
4-(cyclopentyloxysulfamoyl)benzamide
CID 83229494
(3-cyclopentyl-3-methylbutyl)benzene
CID 102410017
4-[(2-amino-1-cyclopentylethyl)sulfamoyl]benzamide
CID 106737961
4-[benzyl-[(1S)-1-cyclopropylethyl]sulfamoyl]benzamide
CID 51926702
4-(cyclohexylmethylsulfamoyl)benzoic acid
CID 18524305
4-N-cyclohexyl-1-N-(2-phenylethyl)benzene-1,4-disulfonamide
CID 1429121
4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide
CID 94182162

Frequently Asked Questions

What is the IUPAC name of 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide?
The IUPAC name of 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide (CID 18513135) is 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide?
The canonical SMILES for 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)NC(CCc2ccccc2)(C(N)=O)C2CCCCC2)cc1.
What is the InChIKey of 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide?
The InChIKey is RIOPLRFWYSDLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O4S/c24-21(27)18-11-13-20(14-12-18)31(29,30)26-23(22(25)28,19-9-5-2-6-10-19)16-15-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19,26H,2,5-6,9-10,15-16H2,(H2,24,27)(H2,25,28).
What are the key properties of 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide?
4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide has a molecular weight of 443.57 g/mol, XLogP of 2.50, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-amino-2-cyclohexyl-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide is sourced from PubChem (CID 18513135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).