N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide

C17H35N3O3S — CID 166209367

IUPACN-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide
SMILESCCCCN(CCCC)S(=O)(=O)N(C)C1CCC(NC(C)=O)CC1
InChIInChI=1S/C17H35N3O3S/c1-5-7-13-20(14-8-6-2)24(22,23)19(4)17-11-9-16(10-12-17)18-15(3)21/h16-17H,5-14H2,1-4H3,(H,18,21)
InChIKeyROOXBVLHLIRVBX-UHFFFAOYSA-N
MW361.55 g/mol
LogP2.51
Rot. Bonds10

About N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide

N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide (PubChem CID 166209367) has the molecular formula C17H35N3O3S and a molecular weight of 361.55 g/mol. Its IUPAC name is N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide
PubChem CID166209367
Molecular FormulaC17H35N3O3S
Molecular Weight361.55 g/mol
Exact Mass361.24
IUPAC NameN-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide
SMILESCCCCN(CCCC)S(=O)(=O)N(C)C1CCC(NC(C)=O)CC1
InChIInChI=1S/C17H35N3O3S/c1-5-7-13-20(14-8-6-2)24(22,23)19(4)17-11-9-16(10-12-17)18-15(3)21/h16-17H,5-14H2,1-4H3,(H,18,21)
InChIKeyROOXBVLHLIRVBX-UHFFFAOYSA-N
XLogP2.51
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.55
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide?
The IUPAC name of N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide (CID 166209367) is N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide.
What is the SMILES notation for N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide?
The canonical SMILES for N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide is CCCCN(CCCC)S(=O)(=O)N(C)C1CCC(NC(C)=O)CC1.
What is the InChIKey of N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide?
The InChIKey is ROOXBVLHLIRVBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O3S/c1-5-7-13-20(14-8-6-2)24(22,23)19(4)17-11-9-16(10-12-17)18-15(3)21/h16-17H,5-14H2,1-4H3,(H,18,21).
What are the key properties of N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide?
N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide has a molecular weight of 361.55 g/mol, XLogP of 2.51, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[dibutylsulfamoyl(methyl)amino]cyclohexyl]acetamide is sourced from PubChem (CID 166209367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).