1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile

C8H15N3O2S — CID 114807690

IUPAC1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile
SMILESCCNS(=O)(=O)NC1(C#N)CCCC1
InChIInChI=1S/C8H15N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-6H2,1H3
InChIKeyPURGWWDZFVLXMC-UHFFFAOYSA-N
MW217.29 g/mol
LogP0.27
Rot. Bonds4

About 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile

1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile (PubChem CID 114807690) has the molecular formula C8H15N3O2S and a molecular weight of 217.29 g/mol. Its IUPAC name is 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile
PubChem CID114807690
Molecular FormulaC8H15N3O2S
Molecular Weight217.29 g/mol
Exact Mass217.09
IUPAC Name1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile
SMILESCCNS(=O)(=O)NC1(C#N)CCCC1
InChIInChI=1S/C8H15N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-6H2,1H3
InChIKeyPURGWWDZFVLXMC-UHFFFAOYSA-N
XLogP0.27
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.29
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2,2-Trifluoroethylsulfamoylamino)cyclopentane-1-carbonitrile
CID 114807687
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
1-Cyano-2-(dimethylsulfamoylamino)cyclopentane
CID 62961810
1-Cyano-2-[[methyl(propan-2-yl)sulfamoyl]amino]cyclopentane
CID 62963450
1-Cyano-2-(sulfamoylamino)cyclopentane
CID 112696449
2-(Cyclopropylsulfamoylamino)cyclopentane-1-carbonitrile
CID 114385535
1-(aminomethyl)-N-(propylsulfamoyl)cyclopentan-1-amine
CID 114803343
1-(aminomethyl)-N-(tert-butylsulfamoyl)cyclopentan-1-amine
CID 114803345
1-(Tert-butylsulfamoylamino)cyclopentane-1-carbonitrile
CID 114807686
1-(Propylsulfamoylamino)cyclopentane-1-carbonitrile
CID 114807688

Frequently Asked Questions

What is the IUPAC name of 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile?
The IUPAC name of 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile (CID 114807690) is 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile is CCNS(=O)(=O)NC1(C#N)CCCC1.
What is the InChIKey of 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile?
The InChIKey is PURGWWDZFVLXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2S/c1-2-10-14(12,13)11-8(7-9)5-3-4-6-8/h10-11H,2-6H2,1H3.
What are the key properties of 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile?
1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile has a molecular weight of 217.29 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylsulfamoylamino)cyclopentane-1-carbonitrile is sourced from PubChem (CID 114807690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).