N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide

C12H20N4O3S — CID 110132192

IUPACN,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCOCC1CCc1cnccn1
InChIInChI=1S/C12H20N4O3S/c1-15(2)20(17,18)16-7-8-19-10-12(16)4-3-11-9-13-5-6-14-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3
InChIKeyVIBNTDFIILZDEZ-UHFFFAOYSA-N
MW300.38 g/mol
LogP-0.08
Rot. Bonds5

About N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide

N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide (PubChem CID 110132192) has the molecular formula C12H20N4O3S and a molecular weight of 300.38 g/mol. Its IUPAC name is N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide
PubChem CID110132192
Molecular FormulaC12H20N4O3S
Molecular Weight300.38 g/mol
Exact Mass300.13
IUPAC NameN,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCOCC1CCc1cnccn1
InChIInChI=1S/C12H20N4O3S/c1-15(2)20(17,18)16-7-8-19-10-12(16)4-3-11-9-13-5-6-14-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3
InChIKeyVIBNTDFIILZDEZ-UHFFFAOYSA-N
XLogP-0.08
TPSA75.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 5-0.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide?
The IUPAC name of N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide (CID 110132192) is N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide.
What is the SMILES notation for N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide?
The canonical SMILES for N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide is CN(C)S(=O)(=O)N1CCOCC1CCc1cnccn1.
What is the InChIKey of N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide?
The InChIKey is VIBNTDFIILZDEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3S/c1-15(2)20(17,18)16-7-8-19-10-12(16)4-3-11-9-13-5-6-14-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide?
N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide has a molecular weight of 300.38 g/mol, XLogP of -0.08, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2-pyrazin-2-ylethyl)morpholine-4-sulfonamide is sourced from PubChem (CID 110132192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).