N-methyl-N-propan-2-ylmorpholine-4-sulfonamide

C8H18N2O3S — CID 60714196

IUPACN-methyl-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-8(2)9(3)14(11,12)10-4-6-13-7-5-10/h8H,4-7H2,1-3H3
InChIKeyOWHDSTFYVIYRGE-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.10
Rot. Bonds3

About N-methyl-N-propan-2-ylmorpholine-4-sulfonamide

N-methyl-N-propan-2-ylmorpholine-4-sulfonamide (PubChem CID 60714196) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is N-methyl-N-propan-2-ylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-ylmorpholine-4-sulfonamide
PubChem CID60714196
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC NameN-methyl-N-propan-2-ylmorpholine-4-sulfonamide
SMILESCC(C)N(C)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H18N2O3S/c1-8(2)9(3)14(11,12)10-4-6-13-7-5-10/h8H,4-7H2,1-3H3
InChIKeyOWHDSTFYVIYRGE-UHFFFAOYSA-N
XLogP-0.10
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
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 N-methyl-N-propan-2-ylmorpholine-4-sulfonamide?
The IUPAC name of N-methyl-N-propan-2-ylmorpholine-4-sulfonamide (CID 60714196) is N-methyl-N-propan-2-ylmorpholine-4-sulfonamide.
What is the SMILES notation for N-methyl-N-propan-2-ylmorpholine-4-sulfonamide?
The canonical SMILES for N-methyl-N-propan-2-ylmorpholine-4-sulfonamide is CC(C)N(C)S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-methyl-N-propan-2-ylmorpholine-4-sulfonamide?
The InChIKey is OWHDSTFYVIYRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-8(2)9(3)14(11,12)10-4-6-13-7-5-10/h8H,4-7H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-ylmorpholine-4-sulfonamide?
N-methyl-N-propan-2-ylmorpholine-4-sulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.10, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-ylmorpholine-4-sulfonamide is sourced from PubChem (CID 60714196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).