N-(2-hydroxyethyl)-N-methylmethanesulfonamide

C4H11NO3S — CID 14868621

IUPACN-(2-hydroxyethyl)-N-methylmethanesulfonamide
SMILESCN(CCO)S(C)(=O)=O
InChIInChI=1S/C4H11NO3S/c1-5(3-4-6)9(2,7)8/h6H,3-4H2,1-2H3
InChIKeyPEGFJIKCJWKGHA-UHFFFAOYSA-N
MW153.20 g/mol
LogP-1.13
Rot. Bonds3

About N-(2-hydroxyethyl)-N-methylmethanesulfonamide

N-(2-hydroxyethyl)-N-methylmethanesulfonamide (PubChem CID 14868621) has the molecular formula C4H11NO3S and a molecular weight of 153.20 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methylmethanesulfonamide
PubChem CID14868621
Molecular FormulaC4H11NO3S
Molecular Weight153.20 g/mol
Exact Mass153.05
IUPAC NameN-(2-hydroxyethyl)-N-methylmethanesulfonamide
SMILESCN(CCO)S(C)(=O)=O
InChIInChI=1S/C4H11NO3S/c1-5(3-4-6)9(2,7)8/h6H,3-4H2,1-2H3
InChIKeyPEGFJIKCJWKGHA-UHFFFAOYSA-N
XLogP-1.13
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.20
LogP ≤ 5-1.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methylmethanesulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methylmethanesulfonamide (CID 14868621) is N-(2-hydroxyethyl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methylmethanesulfonamide is CN(CCO)S(C)(=O)=O.
What is the InChIKey of N-(2-hydroxyethyl)-N-methylmethanesulfonamide?
The InChIKey is PEGFJIKCJWKGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO3S/c1-5(3-4-6)9(2,7)8/h6H,3-4H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-methylmethanesulfonamide?
N-(2-hydroxyethyl)-N-methylmethanesulfonamide has a molecular weight of 153.20 g/mol, XLogP of -1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 14868621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).