2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide

C11H22N2O4S — CID 51080443

IUPAC2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NCC2CCOC2)CC(C)O1
InChIInChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(14,15)12-5-11-3-4-16-8-11/h9-12H,3-8H2,1-2H3
InChIKeyUTIVLNVUYYULDP-UHFFFAOYSA-N
MW278.37 g/mol
LogP-0.03
Rot. Bonds4

About 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide

2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide (PubChem CID 51080443) has the molecular formula C11H22N2O4S and a molecular weight of 278.37 g/mol. Its IUPAC name is 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide.

Molecular Properties

Compound Name2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide
PubChem CID51080443
Molecular FormulaC11H22N2O4S
Molecular Weight278.37 g/mol
Exact Mass278.13
IUPAC Name2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)NCC2CCOC2)CC(C)O1
InChIInChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(14,15)12-5-11-3-4-16-8-11/h9-12H,3-8H2,1-2H3
InChIKeyUTIVLNVUYYULDP-UHFFFAOYSA-N
XLogP-0.03
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide?
The IUPAC name of 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide (CID 51080443) is 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide.
What is the SMILES notation for 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide?
The canonical SMILES for 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide is CC1CN(S(=O)(=O)NCC2CCOC2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide?
The InChIKey is UTIVLNVUYYULDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S/c1-9-6-13(7-10(2)17-9)18(14,15)12-5-11-3-4-16-8-11/h9-12H,3-8H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide?
2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide has a molecular weight of 278.37 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(oxolan-3-ylmethyl)morpholine-4-sulfonamide is sourced from PubChem (CID 51080443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).