N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide

C11H19N3O3S2 — CID 47826948

IUPACN,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)Cc2cscn2)CC(C)O1
InChIInChI=1S/C11H19N3O3S2/c1-9-4-14(5-10(2)17-9)19(15,16)13(3)6-11-7-18-8-12-11/h7-10H,4-6H2,1-3H3
InChIKeyJSOZPMJRYPBHOE-UHFFFAOYSA-N
MW305.43 g/mol
LogP0.93
Rot. Bonds4

About N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide

N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide (PubChem CID 47826948) has the molecular formula C11H19N3O3S2 and a molecular weight of 305.43 g/mol. Its IUPAC name is N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide
PubChem CID47826948
Molecular FormulaC11H19N3O3S2
Molecular Weight305.43 g/mol
Exact Mass305.09
IUPAC NameN,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide
SMILESCC1CN(S(=O)(=O)N(C)Cc2cscn2)CC(C)O1
InChIInChI=1S/C11H19N3O3S2/c1-9-4-14(5-10(2)17-9)19(15,16)13(3)6-11-7-18-8-12-11/h7-10H,4-6H2,1-3H3
InChIKeyJSOZPMJRYPBHOE-UHFFFAOYSA-N
XLogP0.93
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide?
The IUPAC name of N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide (CID 47826948) is N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide.
What is the SMILES notation for N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide?
The canonical SMILES for N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide is CC1CN(S(=O)(=O)N(C)Cc2cscn2)CC(C)O1.
What is the InChIKey of N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide?
The InChIKey is JSOZPMJRYPBHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S2/c1-9-4-14(5-10(2)17-9)19(15,16)13(3)6-11-7-18-8-12-11/h7-10H,4-6H2,1-3H3.
What are the key properties of N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide?
N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide has a molecular weight of 305.43 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,6-trimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-4-sulfonamide is sourced from PubChem (CID 47826948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).