N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide

C27H30N2O4S — CID 4838958

IUPACN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C27H30N2O4S/c1-29(22-14-6-3-7-15-22)34(31,32)26-19-11-9-17-24(26)28-27(30)20-33-25-18-10-8-16-23(25)21-12-4-2-5-13-21/h2,4-5,8-13,16-19,22H,3,6-7,14-15,20H2,1H3,(H,28,30)
InChIKeyRRPFMFCNAGIIKY-UHFFFAOYSA-N
MW478.61 g/mol
LogP5.32
Rot. Bonds8

About N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide

N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide (PubChem CID 4838958) has the molecular formula C27H30N2O4S and a molecular weight of 478.61 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide
PubChem CID4838958
Molecular FormulaC27H30N2O4S
Molecular Weight478.61 g/mol
Exact Mass478.19
IUPAC NameN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C27H30N2O4S/c1-29(22-14-6-3-7-15-22)34(31,32)26-19-11-9-17-24(26)28-27(30)20-33-25-18-10-8-16-23(25)21-12-4-2-5-13-21/h2,4-5,8-13,16-19,22H,3,6-7,14-15,20H2,1H3,(H,28,30)
InChIKeyRRPFMFCNAGIIKY-UHFFFAOYSA-N
XLogP5.32
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.61
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[(2-nitro-3-pyridinyl)oxy]acetamide
CID 29347081
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate
CID 46425533
N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(3-nitrophenoxy)acetamide
CID 30381217
N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide
CID 112829072
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2-(6-methyl-3-pyridinyl)acetate
CID 55995504
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2,5-dimethylfuran-3-carboxylate
CID 16531511
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 55405367
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate
CID 16519558
3-[cycloheptyl(methyl)amino]-N-(2-phenylphenyl)propanamide
CID 55482831
2-(2-chlorophenoxy)-N-[4-[cyclohexyl(methyl)sulfamoyl]phenyl]acetamide
CID 4924223
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 4-thiophen-2-ylbutanoate
CID 30108251
4-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamoylamino]butanoic acid
CID 122084694

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide (CID 4838958) is N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide is CN(C1CCCCC1)S(=O)(=O)c1ccccc1NC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide?
The InChIKey is RRPFMFCNAGIIKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H30N2O4S/c1-29(22-14-6-3-7-15-22)34(31,32)26-19-11-9-17-24(26)28-27(30)20-33-25-18-10-8-16-23(25)21-12-4-2-5-13-21/h2,4-5,8-13,16-19,22H,3,6-7,14-15,20H2,1H3,(H,28,30).
What are the key properties of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide?
N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide has a molecular weight of 478.61 g/mol, XLogP of 5.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 4838958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).