N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide

C11H22N2O3S — CID 62050114

IUPACN-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide
SMILESCCN(C1CCNC1)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H22N2O3S/c1-2-13(10-3-6-12-9-10)17(14,15)11-4-7-16-8-5-11/h10-12H,2-9H2,1H3
InChIKeyJKOPNQFLBAUIAN-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.18
Rot. Bonds4

About N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide

N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide (PubChem CID 62050114) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide
PubChem CID62050114
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide
SMILESCCN(C1CCNC1)S(=O)(=O)C1CCOCC1
InChIInChI=1S/C11H22N2O3S/c1-2-13(10-3-6-12-9-10)17(14,15)11-4-7-16-8-5-11/h10-12H,2-9H2,1H3
InChIKeyJKOPNQFLBAUIAN-UHFFFAOYSA-N
XLogP0.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-{(3S,4R)-4-[(dimethylamino)methyl]-1-tetrahydro-2H-pyran-4-yltetrahydro-1H-pyrrol-3-yl}-1-ethanesulfonamide
CID 91923054
N~1~-{(3S,4R)-4-[(Dimethylamino)methyl]-1-tetrahydro-2H-pyran-4-yltetrahydro-1H-pyrrol-3-YL}-1-butanesulfonamide
CID 91923058
N-[2-[oxan-4-yl(propan-2-yl)amino]ethyl]ethanesulfonamide
CID 72003186
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-methoxypropane-2-sulfonamide
CID 75510917
N-(1-cyclopropyl-4-methylpyrrolidin-3-yl)-1-(oxan-4-yl)methanesulfonamide
CID 127458683
N-[2-[butan-2-yl(methyl)amino]ethyl]oxane-4-sulfonamide
CID 56803800
1-(Oxolan-2-ylmethylsulfonyl)piperidin-4-amine
CID 63246231
3-Methyl-1-(oxan-4-ylsulfonyl)piperazine
CID 65448066
N-[2-(oxan-4-ylamino)ethyl]methanesulfonamide
CID 43608588
N-(oxan-4-yl)-3-(propan-2-ylamino)propane-1-sulfonamide
CID 54972284
N-methyl-N-(oxan-4-yl)-2-(propan-2-ylamino)ethanesulfonamide
CID 54972333
N-methyl-N-(oxan-4-yl)-1-pyrrolidin-2-ylmethanesulfonamide
CID 54972383

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide?
The IUPAC name of N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide (CID 62050114) is N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide.
What is the SMILES notation for N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide?
The canonical SMILES for N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide is CCN(C1CCNC1)S(=O)(=O)C1CCOCC1.
What is the InChIKey of N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide?
The InChIKey is JKOPNQFLBAUIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-2-13(10-3-6-12-9-10)17(14,15)11-4-7-16-8-5-11/h10-12H,2-9H2,1H3.
What are the key properties of N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide?
N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-pyrrolidin-3-yloxane-4-sulfonamide is sourced from PubChem (CID 62050114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).