N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine

C9H21N3O2S — CID 63766177

IUPACN'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine
SMILESCN(C)S(=O)(=O)N(CCN)C1CCCC1
InChIInChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(8-7-10)9-5-3-4-6-9/h9H,3-8,10H2,1-2H3
InChIKeyVRLBLHDOAGLHRS-UHFFFAOYSA-N
MW235.35 g/mol
LogP-0.00
Rot. Bonds5

About N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine

N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine (PubChem CID 63766177) has the molecular formula C9H21N3O2S and a molecular weight of 235.35 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine
PubChem CID63766177
Molecular FormulaC9H21N3O2S
Molecular Weight235.35 g/mol
Exact Mass235.14
IUPAC NameN'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine
SMILESCN(C)S(=O)(=O)N(CCN)C1CCCC1
InChIInChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(8-7-10)9-5-3-4-6-9/h9H,3-8,10H2,1-2H3
InChIKeyVRLBLHDOAGLHRS-UHFFFAOYSA-N
XLogP-0.00
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine (CID 63766177) is N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine is CN(C)S(=O)(=O)N(CCN)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine?
The InChIKey is VRLBLHDOAGLHRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S/c1-11(2)15(13,14)12(8-7-10)9-5-3-4-6-9/h9H,3-8,10H2,1-2H3.
What are the key properties of N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine?
N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine has a molecular weight of 235.35 g/mol, XLogP of -0.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(dimethylsulfamoyl)ethane-1,2-diamine is sourced from PubChem (CID 63766177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).