N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide

C15H26N4O3S — CID 110132287

IUPACN,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCOCC1CCc1nccnc1C
InChIInChI=1S/C15H26N4O3S/c1-4-18(5-2)23(20,21)19-10-11-22-12-14(19)6-7-15-13(3)16-8-9-17-15/h8-9,14H,4-7,10-12H2,1-3H3
InChIKeyPRCUAFRYTZDWRQ-UHFFFAOYSA-N
MW342.47 g/mol
LogP1.01
Rot. Bonds7

About N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide

N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide (PubChem CID 110132287) has the molecular formula C15H26N4O3S and a molecular weight of 342.47 g/mol. Its IUPAC name is N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide
PubChem CID110132287
Molecular FormulaC15H26N4O3S
Molecular Weight342.47 g/mol
Exact Mass342.17
IUPAC NameN,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide
SMILESCCN(CC)S(=O)(=O)N1CCOCC1CCc1nccnc1C
InChIInChI=1S/C15H26N4O3S/c1-4-18(5-2)23(20,21)19-10-11-22-12-14(19)6-7-15-13(3)16-8-9-17-15/h8-9,14H,4-7,10-12H2,1-3H3
InChIKeyPRCUAFRYTZDWRQ-UHFFFAOYSA-N
XLogP1.01
TPSA75.63 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.47
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide?
The IUPAC name of N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide (CID 110132287) is N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide.
What is the SMILES notation for N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide?
The canonical SMILES for N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide is CCN(CC)S(=O)(=O)N1CCOCC1CCc1nccnc1C.
What is the InChIKey of N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide?
The InChIKey is PRCUAFRYTZDWRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O3S/c1-4-18(5-2)23(20,21)19-10-11-22-12-14(19)6-7-15-13(3)16-8-9-17-15/h8-9,14H,4-7,10-12H2,1-3H3.
What are the key properties of N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide?
N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide has a molecular weight of 342.47 g/mol, XLogP of 1.01, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[2-(3-methylpyrazin-2-yl)ethyl]morpholine-4-sulfonamide is sourced from PubChem (CID 110132287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).