1-cyano-2-(dimethylsulfamoylamino)cyclopentane

C8H15N3O2S — CID 62961810

IUPAC1-cyano-2-(dimethylsulfamoylamino)cyclopentane
SMILESCN(C)S(=O)(=O)NC1CCCC1C#N
InChIInChI=1S/C8H15N3O2S/c1-11(2)14(12,13)10-8-5-3-4-7(8)6-9/h7-8,10H,3-5H2,1-2H3
InChIKeyPNFDTAVFAYURSS-UHFFFAOYSA-N
MW217.29 g/mol
LogP0.07
Rot. Bonds3

About 1-cyano-2-(dimethylsulfamoylamino)cyclopentane

1-cyano-2-(dimethylsulfamoylamino)cyclopentane (PubChem CID 62961810) has the molecular formula C8H15N3O2S and a molecular weight of 217.29 g/mol. Its IUPAC name is 1-cyano-2-(dimethylsulfamoylamino)cyclopentane.

Molecular Properties

Compound Name1-cyano-2-(dimethylsulfamoylamino)cyclopentane
PubChem CID62961810
Molecular FormulaC8H15N3O2S
Molecular Weight217.29 g/mol
Exact Mass217.09
IUPAC Name1-cyano-2-(dimethylsulfamoylamino)cyclopentane
SMILESCN(C)S(=O)(=O)NC1CCCC1C#N
InChIInChI=1S/C8H15N3O2S/c1-11(2)14(12,13)10-8-5-3-4-7(8)6-9/h7-8,10H,3-5H2,1-2H3
InChIKeyPNFDTAVFAYURSS-UHFFFAOYSA-N
XLogP0.07
TPSA73.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyano-2-(dimethylsulfamoylamino)cyclopentane?
The IUPAC name of 1-cyano-2-(dimethylsulfamoylamino)cyclopentane (CID 62961810) is 1-cyano-2-(dimethylsulfamoylamino)cyclopentane.
What is the SMILES notation for 1-cyano-2-(dimethylsulfamoylamino)cyclopentane?
The canonical SMILES for 1-cyano-2-(dimethylsulfamoylamino)cyclopentane is CN(C)S(=O)(=O)NC1CCCC1C#N.
What is the InChIKey of 1-cyano-2-(dimethylsulfamoylamino)cyclopentane?
The InChIKey is PNFDTAVFAYURSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2S/c1-11(2)14(12,13)10-8-5-3-4-7(8)6-9/h7-8,10H,3-5H2,1-2H3.
What are the key properties of 1-cyano-2-(dimethylsulfamoylamino)cyclopentane?
1-cyano-2-(dimethylsulfamoylamino)cyclopentane has a molecular weight of 217.29 g/mol, XLogP of 0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyano-2-(dimethylsulfamoylamino)cyclopentane is sourced from PubChem (CID 62961810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).