N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide

C10H18N2O2S — CID 82128566

IUPACN-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C10H18N2O2S/c1-3-8-15(13,14)12(2)10(9-11)6-4-5-7-10/h3-8H2,1-2H3
InChIKeyBZRONMDQAHNGNG-UHFFFAOYSA-N
MW230.33 g/mol
LogP1.49
Rot. Bonds4

About N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide

N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide (PubChem CID 82128566) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide
PubChem CID82128566
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC NameN-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C10H18N2O2S/c1-3-8-15(13,14)12(2)10(9-11)6-4-5-7-10/h3-8H2,1-2H3
InChIKeyBZRONMDQAHNGNG-UHFFFAOYSA-N
XLogP1.49
TPSA61.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyanocyclopentyl)-N-methylmethanesulfonamide
CID 82126066
1-(4-Propylsulfonylpiperazin-1-yl)cyclopentane-1-carbonitrile
CID 58561845
N-(1-cyanocyclopentyl)propane-2-sulfonamide
CID 61123668
N-(1-cyanocyclopentyl)butane-1-sulfonamide
CID 55138336
1-(1,1-Dioxo-1,2-thiazolidin-2-yl)cyclopentane-1-carbonitrile
CID 61122152
N-(1-cyanocyclopentyl)propane-1-sulfonamide
CID 61124468
1-cyano-N-(cyclopentylmethyl)-N-methylmethanesulfonamide
CID 63657950
1-(Dimethylamino)-2-methylsulfonylcyclopentane-1-carbonitrile
CID 65050269
2-(2,2-Dimethylpyrrolidin-1-yl)sulfonylbutanenitrile
CID 65565848
1-cyano-N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
CID 65566279
1-cyano-N-(cyclopentylmethyl)-N-methylethanesulfonamide
CID 65566280
1-cyano-N-(1-methylcyclopentyl)propane-1-sulfonamide
CID 65567383

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide?
The IUPAC name of N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide (CID 82128566) is N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide is CCCS(=O)(=O)N(C)C1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide?
The InChIKey is BZRONMDQAHNGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S/c1-3-8-15(13,14)12(2)10(9-11)6-4-5-7-10/h3-8H2,1-2H3.
What are the key properties of N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide?
N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide has a molecular weight of 230.33 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-N-methylpropane-1-sulfonamide is sourced from PubChem (CID 82128566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).