N-ethyl-2-morpholin-4-ylethanesulfonamide

C8H18N2O3S — CID 58968861

IUPACN-ethyl-2-morpholin-4-ylethanesulfonamide
SMILESCCNS(=O)(=O)CCN1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-2-9-14(11,12)8-5-10-3-6-13-7-4-10/h9H,2-8H2,1H3
InChIKeySOKXPWWCHUWCFL-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.74
Rot. Bonds5

About N-ethyl-2-morpholin-4-ylethanesulfonamide

N-ethyl-2-morpholin-4-ylethanesulfonamide (PubChem CID 58968861) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is N-ethyl-2-morpholin-4-ylethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-2-morpholin-4-ylethanesulfonamide
PubChem CID58968861
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC NameN-ethyl-2-morpholin-4-ylethanesulfonamide
SMILESCCNS(=O)(=O)CCN1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-2-9-14(11,12)8-5-10-3-6-13-7-4-10/h9H,2-8H2,1H3
InChIKeySOKXPWWCHUWCFL-UHFFFAOYSA-N
XLogP-0.74
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-morpholin-4-ylethanesulfonamide?
The IUPAC name of N-ethyl-2-morpholin-4-ylethanesulfonamide (CID 58968861) is N-ethyl-2-morpholin-4-ylethanesulfonamide.
What is the SMILES notation for N-ethyl-2-morpholin-4-ylethanesulfonamide?
The canonical SMILES for N-ethyl-2-morpholin-4-ylethanesulfonamide is CCNS(=O)(=O)CCN1CCOCC1.
What is the InChIKey of N-ethyl-2-morpholin-4-ylethanesulfonamide?
The InChIKey is SOKXPWWCHUWCFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-2-9-14(11,12)8-5-10-3-6-13-7-4-10/h9H,2-8H2,1H3.
What are the key properties of N-ethyl-2-morpholin-4-ylethanesulfonamide?
N-ethyl-2-morpholin-4-ylethanesulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-morpholin-4-ylethanesulfonamide is sourced from PubChem (CID 58968861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).