2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide

C8H18N2O3S — CID 57452710

IUPAC2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCOCC1CCCN1S(=O)(=O)N(C)C
InChIInChI=1S/C8H18N2O3S/c1-9(2)14(11,12)10-6-4-5-8(10)7-13-3/h8H,4-7H2,1-3H3
InChIKeyWTUKYDDLSICBQO-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.10
Rot. Bonds4

About 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide

2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide (PubChem CID 57452710) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
PubChem CID57452710
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCOCC1CCCN1S(=O)(=O)N(C)C
InChIInChI=1S/C8H18N2O3S/c1-9(2)14(11,12)10-6-4-5-8(10)7-13-3/h8H,4-7H2,1-3H3
InChIKeyWTUKYDDLSICBQO-UHFFFAOYSA-N
XLogP-0.10
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The IUPAC name of 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide (CID 57452710) is 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide.
What is the SMILES notation for 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The canonical SMILES for 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide is COCC1CCCN1S(=O)(=O)N(C)C.
What is the InChIKey of 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The InChIKey is WTUKYDDLSICBQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-9(2)14(11,12)10-6-4-5-8(10)7-13-3/h8H,4-7H2,1-3H3.
What are the key properties of 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.10, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N,N-dimethylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 57452710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).