N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide

C7H15NO3S — CID 62732376

IUPACN,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide
SMILESCN(C)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C7H15NO3S/c1-8(2)12(9,10)6-7-4-3-5-11-7/h7H,3-6H2,1-2H3
InChIKeyHKXMAXZMDRLGJI-UHFFFAOYSA-N
MW193.27 g/mol
LogP0.06
Rot. Bonds3

About N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide

N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide (PubChem CID 62732376) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide
PubChem CID62732376
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC NameN,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide
SMILESCN(C)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C7H15NO3S/c1-8(2)12(9,10)6-7-4-3-5-11-7/h7H,3-6H2,1-2H3
InChIKeyHKXMAXZMDRLGJI-UHFFFAOYSA-N
XLogP0.06
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide?
The IUPAC name of N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide (CID 62732376) is N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide.
What is the SMILES notation for N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide?
The canonical SMILES for N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide is CN(C)S(=O)(=O)CC1CCCO1.
What is the InChIKey of N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide?
The InChIKey is HKXMAXZMDRLGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-8(2)12(9,10)6-7-4-3-5-11-7/h7H,3-6H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide?
N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide has a molecular weight of 193.27 g/mol, XLogP of 0.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(oxolan-2-yl)methanesulfonamide is sourced from PubChem (CID 62732376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).