ethane;N-(3-methyloxolan-3-yl)methanesulfonamide

C8H19NO3S — CID 167494092

IUPACethane;N-(3-methyloxolan-3-yl)methanesulfonamide
SMILESCC.CC1(NS(C)(=O)=O)CCOC1
InChIInChI=1S/C6H13NO3S.C2H6/c1-6(3-4-10-5-6)7-11(2,8)9;1-2/h7H,3-5H2,1-2H3;1-2H3
InChIKeyMGNCLUSFNMSCEP-UHFFFAOYSA-N
MW209.31 g/mol
LogP0.74
Rot. Bonds2

About ethane;N-(3-methyloxolan-3-yl)methanesulfonamide

ethane;N-(3-methyloxolan-3-yl)methanesulfonamide (PubChem CID 167494092) has the molecular formula C8H19NO3S and a molecular weight of 209.31 g/mol. Its IUPAC name is ethane;N-(3-methyloxolan-3-yl)methanesulfonamide.

Molecular Properties

Compound Nameethane;N-(3-methyloxolan-3-yl)methanesulfonamide
PubChem CID167494092
Molecular FormulaC8H19NO3S
Molecular Weight209.31 g/mol
Exact Mass209.11
IUPAC Nameethane;N-(3-methyloxolan-3-yl)methanesulfonamide
SMILESCC.CC1(NS(C)(=O)=O)CCOC1
InChIInChI=1S/C6H13NO3S.C2H6/c1-6(3-4-10-5-6)7-11(2,8)9;1-2/h7H,3-5H2,1-2H3;1-2H3
InChIKeyMGNCLUSFNMSCEP-UHFFFAOYSA-N
XLogP0.74
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-(3-methyloxolan-3-yl)methanesulfonamide
CID 167493461
3-methyl-3-(sulfamoylamino)oxolane
CID 115766552
2-chloro-N-(3-methyloxolan-3-yl)ethanesulfonamide
CID 107652467
N-(3-methyloxolan-3-yl)-1H-pyrazole-5-sulfonamide
CID 102693380
5-methyl-4-[(3-methyloxolan-3-yl)sulfamoyl]-1H-pyrazole-3-carboxylic acid
CID 113481928
N-(3-methyloxan-3-yl)benzenesulfonamide
CID 103896537
4-(ethylamino)-2,6-dimethyl-N-(3-methyloxolan-3-yl)benzenesulfonamide
CID 107329156
2-amino-4-methyl-N-(3-methyloxolan-3-yl)-1,3-thiazole-5-sulfonamide
CID 113482141
5,6-dichloro-N-(3-methyloxolan-3-yl)pyridine-3-sulfonamide
CID 115767149
3-(hydroxymethyl)-N-(3-methyloxolan-3-yl)benzenesulfonamide
CID 113482368
3,6-difluoro-2-methoxy-N-(3-methyloxan-3-yl)benzenesulfonamide
CID 166272026
1-cyano-N-(4-methyloxan-4-yl)methanesulfonamide
CID 115766982

Frequently Asked Questions

What is the IUPAC name of ethane;N-(3-methyloxolan-3-yl)methanesulfonamide?
The IUPAC name of ethane;N-(3-methyloxolan-3-yl)methanesulfonamide (CID 167494092) is ethane;N-(3-methyloxolan-3-yl)methanesulfonamide.
What is the SMILES notation for ethane;N-(3-methyloxolan-3-yl)methanesulfonamide?
The canonical SMILES for ethane;N-(3-methyloxolan-3-yl)methanesulfonamide is CC.CC1(NS(C)(=O)=O)CCOC1.
What is the InChIKey of ethane;N-(3-methyloxolan-3-yl)methanesulfonamide?
The InChIKey is MGNCLUSFNMSCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3S.C2H6/c1-6(3-4-10-5-6)7-11(2,8)9;1-2/h7H,3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;N-(3-methyloxolan-3-yl)methanesulfonamide?
ethane;N-(3-methyloxolan-3-yl)methanesulfonamide has a molecular weight of 209.31 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(3-methyloxolan-3-yl)methanesulfonamide is sourced from PubChem (CID 167494092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).