ethane;N-(3-methylcyclopentyl)methanesulfonamide

C9H21NO2S — CID 167493684

IUPACethane;N-(3-methylcyclopentyl)methanesulfonamide
SMILESCC.CC1CCC(NS(C)(=O)=O)C1
InChIInChI=1S/C7H15NO2S.C2H6/c1-6-3-4-7(5-6)8-11(2,9)10;1-2/h6-8H,3-5H2,1-2H3;1-2H3
InChIKeyCKWAWOVKFHGVHB-UHFFFAOYSA-N
MW207.34 g/mol
LogP1.75
Rot. Bonds2

About ethane;N-(3-methylcyclopentyl)methanesulfonamide

ethane;N-(3-methylcyclopentyl)methanesulfonamide (PubChem CID 167493684) has the molecular formula C9H21NO2S and a molecular weight of 207.34 g/mol. Its IUPAC name is ethane;N-(3-methylcyclopentyl)methanesulfonamide.

Molecular Properties

Compound Nameethane;N-(3-methylcyclopentyl)methanesulfonamide
PubChem CID167493684
Molecular FormulaC9H21NO2S
Molecular Weight207.34 g/mol
Exact Mass207.13
IUPAC Nameethane;N-(3-methylcyclopentyl)methanesulfonamide
SMILESCC.CC1CCC(NS(C)(=O)=O)C1
InChIInChI=1S/C7H15NO2S.C2H6/c1-6-3-4-7(5-6)8-11(2,9)10;1-2/h6-8H,3-5H2,1-2H3;1-2H3
InChIKeyCKWAWOVKFHGVHB-UHFFFAOYSA-N
XLogP1.75
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.34
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-(aminomethyl)cyclopentyl)methanesulfonamide hydrochloride
CID 71755945
N-(2-ethylhexyl)methanesulfonamide
CID 5176352
N-[2-(aminomethyl)cyclopentyl]methanesulfonamide
CID 62955165
3,3,3-trifluoro-N-[(1R,3S)-3-methylcyclopentyl]propane-1-sulfonamide
CID 68316105
N-[(1R,3S)-3-ethylcyclopentyl]-3-fluoropropane-1-sulfonamide
CID 70642520
N-[(3S)-3-ethylcyclopentyl]-2-methylpropane-2-sulfonamide
CID 134966480
1,1,1-trifluoro-N-(3-methylcyclopentyl)methanesulfonamide
CID 14967680
1,1-difluoro-N-(3-methylcyclopentyl)methanesulfonamide
CID 114545159
4,4,4-trifluoro-N-(3-methylcyclopentyl)butane-1-sulfonamide
CID 114545331
rac-[(1R,3S)-3-aminocyclopentyl]methanesulfonamide
CID 132371658
N-(5-methylhexan-2-yl)propane-2-sulfonamide
CID 61361229
N-(6-methylheptan-2-yl)methanesulfonamide
CID 2916151

Frequently Asked Questions

What is the IUPAC name of ethane;N-(3-methylcyclopentyl)methanesulfonamide?
The IUPAC name of ethane;N-(3-methylcyclopentyl)methanesulfonamide (CID 167493684) is ethane;N-(3-methylcyclopentyl)methanesulfonamide.
What is the SMILES notation for ethane;N-(3-methylcyclopentyl)methanesulfonamide?
The canonical SMILES for ethane;N-(3-methylcyclopentyl)methanesulfonamide is CC.CC1CCC(NS(C)(=O)=O)C1.
What is the InChIKey of ethane;N-(3-methylcyclopentyl)methanesulfonamide?
The InChIKey is CKWAWOVKFHGVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S.C2H6/c1-6-3-4-7(5-6)8-11(2,9)10;1-2/h6-8H,3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;N-(3-methylcyclopentyl)methanesulfonamide?
ethane;N-(3-methylcyclopentyl)methanesulfonamide has a molecular weight of 207.34 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(3-methylcyclopentyl)methanesulfonamide is sourced from PubChem (CID 167493684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).