N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide

C10H17N3O3S2 — CID 131644316

IUPACN,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide
SMILESCc1nc(C2COCCN2S(=O)(=O)N(C)C)cs1
InChIInChI=1S/C10H17N3O3S2/c1-8-11-9(7-17-8)10-6-16-5-4-13(10)18(14,15)12(2)3/h7,10H,4-6H2,1-3H3
InChIKeyBMCYHMBUUXDTST-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.63
Rot. Bonds3

About N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide

N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide (PubChem CID 131644316) has the molecular formula C10H17N3O3S2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide
PubChem CID131644316
Molecular FormulaC10H17N3O3S2
Molecular Weight291.40 g/mol
Exact Mass291.07
IUPAC NameN,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide
SMILESCc1nc(C2COCCN2S(=O)(=O)N(C)C)cs1
InChIInChI=1S/C10H17N3O3S2/c1-8-11-9(7-17-8)10-6-16-5-4-13(10)18(14,15)12(2)3/h7,10H,4-6H2,1-3H3
InChIKeyBMCYHMBUUXDTST-UHFFFAOYSA-N
XLogP0.63
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.63
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-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide?
The IUPAC name of N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide (CID 131644316) is N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide.
What is the SMILES notation for N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide?
The canonical SMILES for N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide is Cc1nc(C2COCCN2S(=O)(=O)N(C)C)cs1.
What is the InChIKey of N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide?
The InChIKey is BMCYHMBUUXDTST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S2/c1-8-11-9(7-17-8)10-6-16-5-4-13(10)18(14,15)12(2)3/h7,10H,4-6H2,1-3H3.
What are the key properties of N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide?
N,N-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide has a molecular weight of 291.40 g/mol, XLogP of 0.63, 3 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-methyl-1,3-thiazol-4-yl)morpholine-4-sulfonamide is sourced from PubChem (CID 131644316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).