1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile

C9H17N3O2S — CID 82128696

IUPAC1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile
SMILESCN(C)S(=O)(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C9H17N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-7H2,1-3H3
InChIKeyBHMQRUZFWXGCAK-UHFFFAOYSA-N
MW231.32 g/mol
LogP0.56
Rot. Bonds3

About 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile

1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile (PubChem CID 82128696) has the molecular formula C9H17N3O2S and a molecular weight of 231.32 g/mol. Its IUPAC name is 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile
PubChem CID82128696
Molecular FormulaC9H17N3O2S
Molecular Weight231.32 g/mol
Exact Mass231.10
IUPAC Name1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile
SMILESCN(C)S(=O)(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C9H17N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-7H2,1-3H3
InChIKeyBHMQRUZFWXGCAK-UHFFFAOYSA-N
XLogP0.56
TPSA64.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile with MolForge

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

Launch Full Analysis

Related Compounds

N-(1-cyanocyclopentyl)-N-methylmethanesulfonamide
CID 82126066
1-Cyano-1-(diethylsulfamoylamino)cyclopentane
CID 55029365
1-Cyano-1-(dimethylsulfamoylamino)cyclopentane
CID 61125065
1-Cyano-1-[[methyl(propan-2-yl)sulfamoyl]amino]cyclopentane
CID 61453751
N-(1-cyanocyclopentyl)-N-methylethanesulfonamide
CID 82127082
N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide
CID 82128566
1-[Dimethylsulfamoyl(methyl)amino]cyclohexane-1-carbonitrile
CID 82130549
N-(1-cyanocyclopentyl)-N-methylbutane-1-sulfonamide
CID 94688500

Frequently Asked Questions

What is the IUPAC name of 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile?
The IUPAC name of 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile (CID 82128696) is 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile?
The canonical SMILES for 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile is CN(C)S(=O)(=O)N(C)C1(C#N)CCCC1.
What is the InChIKey of 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile?
The InChIKey is BHMQRUZFWXGCAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2S/c1-11(2)15(13,14)12(3)9(8-10)6-4-5-7-9/h4-7H2,1-3H3.
What are the key properties of 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile?
1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile has a molecular weight of 231.32 g/mol, XLogP of 0.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethylsulfamoyl(methyl)amino]cyclopentane-1-carbonitrile is sourced from PubChem (CID 82128696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).