N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide

C15H30N4O3S — CID 34782219

IUPACN-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide
SMILESCN(C)S(=O)(=O)N1CCN(CC(=O)NC2CCCCCC2)CC1
InChIInChI=1S/C15H30N4O3S/c1-17(2)23(21,22)19-11-9-18(10-12-19)13-15(20)16-14-7-5-3-4-6-8-14/h14H,3-13H2,1-2H3,(H,16,20)
InChIKeyRTMWQMNGBKFKRO-UHFFFAOYSA-N
MW346.50 g/mol
LogP0.25
Rot. Bonds5

About N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide

N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide (PubChem CID 34782219) has the molecular formula C15H30N4O3S and a molecular weight of 346.50 g/mol. Its IUPAC name is N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide
PubChem CID34782219
Molecular FormulaC15H30N4O3S
Molecular Weight346.50 g/mol
Exact Mass346.20
IUPAC NameN-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide
SMILESCN(C)S(=O)(=O)N1CCN(CC(=O)NC2CCCCCC2)CC1
InChIInChI=1S/C15H30N4O3S/c1-17(2)23(21,22)19-11-9-18(10-12-19)13-15(20)16-14-7-5-3-4-6-8-14/h14H,3-13H2,1-2H3,(H,16,20)
InChIKeyRTMWQMNGBKFKRO-UHFFFAOYSA-N
XLogP0.25
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.50
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide?
The IUPAC name of N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide (CID 34782219) is N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide is CN(C)S(=O)(=O)N1CCN(CC(=O)NC2CCCCCC2)CC1.
What is the InChIKey of N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide?
The InChIKey is RTMWQMNGBKFKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O3S/c1-17(2)23(21,22)19-11-9-18(10-12-19)13-15(20)16-14-7-5-3-4-6-8-14/h14H,3-13H2,1-2H3,(H,16,20).
What are the key properties of N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide?
N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide has a molecular weight of 346.50 g/mol, XLogP of 0.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[4-(dimethylsulfamoyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 34782219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).