N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide

C22H35N3O3S — CID 112829072

IUPACN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1)C1CCCC1
InChIInChI=1S/C22H35N3O3S/c1-3-25(19-13-7-8-14-19)17-22(26)23-20-15-9-10-16-21(20)29(27,28)24(2)18-11-5-4-6-12-18/h9-10,15-16,18-19H,3-8,11-14,17H2,1-2H3,(H,23,26)
InChIKeyGBQCZLNVYXNJEQ-UHFFFAOYSA-N
MW421.61 g/mol
LogP3.84
Rot. Bonds8

About N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide

N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide (PubChem CID 112829072) has the molecular formula C22H35N3O3S and a molecular weight of 421.61 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide
PubChem CID112829072
Molecular FormulaC22H35N3O3S
Molecular Weight421.61 g/mol
Exact Mass421.24
IUPAC NameN-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1)C1CCCC1
InChIInChI=1S/C22H35N3O3S/c1-3-25(19-13-7-8-14-19)17-22(26)23-20-15-9-10-16-21(20)29(27,28)24(2)18-11-5-4-6-12-18/h9-10,15-16,18-19H,3-8,11-14,17H2,1-2H3,(H,23,26)
InChIKeyGBQCZLNVYXNJEQ-UHFFFAOYSA-N
XLogP3.84
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.61
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-(2-phenylphenoxy)acetamide
CID 4838958
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate
CID 46425533
N-(2-tert-butylphenyl)-2-[cyclopropyl(ethyl)amino]acetamide
CID 86928197
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2,5-dimethylfuran-3-carboxylate
CID 16531511
4-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]carbamoylamino]butanoic acid
CID 122084694
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate
CID 16519558
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2,5,6-trimethyl-3-oxopyridazine-4-carboxylate
CID 55536343
2-[ethyl(piperidin-4-yl)amino]-N-(2-methylphenyl)acetamide
CID 60805607
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 55405367
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]acetamide
CID 16539548
2-[cycloheptyl(methyl)sulfamoyl]benzoic acid
CID 43613846
[2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 2-(6-methyl-3-pyridinyl)acetate
CID 55995504

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide?
The IUPAC name of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide (CID 112829072) is N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide.
What is the SMILES notation for N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide?
The canonical SMILES for N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide is CCN(CC(=O)Nc1ccccc1S(=O)(=O)N(C)C1CCCCC1)C1CCCC1.
What is the InChIKey of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide?
The InChIKey is GBQCZLNVYXNJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O3S/c1-3-25(19-13-7-8-14-19)17-22(26)23-20-15-9-10-16-21(20)29(27,28)24(2)18-11-5-4-6-12-18/h9-10,15-16,18-19H,3-8,11-14,17H2,1-2H3,(H,23,26).
What are the key properties of N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide?
N-[2-[cyclohexyl(methyl)sulfamoyl]phenyl]-2-[cyclopentyl(ethyl)amino]acetamide has a molecular weight of 421.61 g/mol, XLogP of 3.84, 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-[cyclopentyl(ethyl)amino]acetamide is sourced from PubChem (CID 112829072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).