N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide

C21H26N2O4S — CID 2973953

IUPACN-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C21H26N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h3,6-7,10-16,18,23H,2,4-5,8-9H2,1H3,(H,22,24)
InChIKeyWCJUFRDLHRYUTQ-UHFFFAOYSA-N
MW402.52 g/mol
LogP3.70
Rot. Bonds7

About N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide

N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide (PubChem CID 2973953) has the molecular formula C21H26N2O4S and a molecular weight of 402.52 g/mol. Its IUPAC name is N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
PubChem CID2973953
Molecular FormulaC21H26N2O4S
Molecular Weight402.52 g/mol
Exact Mass402.16
IUPAC NameN-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C21H26N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h3,6-7,10-16,18,23H,2,4-5,8-9H2,1H3,(H,22,24)
InChIKeyWCJUFRDLHRYUTQ-UHFFFAOYSA-N
XLogP3.70
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.52
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide 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

(2R)-2-[4-(cyclohexylsulfamoyl)phenoxy]-N-methylpropanamide
CID 92513134
(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-2-methoxypropanamide
CID 124730678
2-phenoxy-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 4939919
2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 3148025
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-phenoxypropanamide
CID 4939891
2-phenoxy-N-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 2948246
2,2-dichloro-N-[4-(cyclohexylsulfamoyl)phenyl]acetamide
CID 2228727
(2S)-N-[4-(cyclopentylsulfamoyl)phenyl]-3-methoxy-2-methylpropanamide
CID 124843343
(2R)-N-cycloheptyl-2-phenoxypropanamide
CID 669971
(2R)-2-(4-methoxyphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41479035
(2R)-2-(4-methylphenoxy)-N-[4-(phenylsulfamoyl)phenyl]propanamide
CID 41269416
methyl N-[4-(cyclohexylsulfamoyl)phenyl]carbamate
CID 6465161

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide?
The IUPAC name of N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide (CID 2973953) is N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide?
The canonical SMILES for N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide?
The InChIKey is WCJUFRDLHRYUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4S/c1-16(27-19-10-6-3-7-11-19)21(24)22-17-12-14-20(15-13-17)28(25,26)23-18-8-4-2-5-9-18/h3,6-7,10-16,18,23H,2,4-5,8-9H2,1H3,(H,22,24).
What are the key properties of N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide?
N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide has a molecular weight of 402.52 g/mol, XLogP of 3.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide is sourced from PubChem (CID 2973953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).