2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide

C11H19N3O3S2 — CID 154789685

IUPAC2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide
SMILESCc1ncsc1CNS(=O)(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H19N3O3S2/c1-9-10(18-8-12-9)6-13-19(15,16)14-4-5-17-11(2,3)7-14/h8,13H,4-7H2,1-3H3
InChIKeyLUAPZUCGVYIWSC-UHFFFAOYSA-N
MW305.43 g/mol
LogP0.90
Rot. Bonds4

About 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide

2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide (PubChem CID 154789685) has the molecular formula C11H19N3O3S2 and a molecular weight of 305.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide
PubChem CID154789685
Molecular FormulaC11H19N3O3S2
Molecular Weight305.43 g/mol
Exact Mass305.09
IUPAC Name2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide
SMILESCc1ncsc1CNS(=O)(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H19N3O3S2/c1-9-10(18-8-12-9)6-13-19(15,16)14-4-5-17-11(2,3)7-14/h8,13H,4-7H2,1-3H3
InChIKeyLUAPZUCGVYIWSC-UHFFFAOYSA-N
XLogP0.90
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Methyl-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-2-carboxamide
CID 73439585
(2-Methoxyethyl)[(4-methyl-1,3-thiazol-5-yl)methyl]amine
CID 62544618
N-[(2,5-dimethyl-1,3-thiazol-4-yl)methyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 75433577
N-[(2-Ethyl-4-methyl-1,3-thiazol-5-YL)methyl]morpholine-4-sulfonamide
CID 122566857
2,2,6,6-Tetramethyl-N-[(4-methyl-1,3-thiazol-5-YL)methyl]morpholine-4-carboxamide
CID 86805387
4-[(4-Methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 130383068
2-ethoxy-N'-methyl-N'-[(4-methyl-1,3-thiazol-5-yl)methyl]butane-1,4-diamine
CID 55261534
(1-Methoxypropan-2-yl)[(4-methyl-1,3-thiazol-5-yl)methyl]amine
CID 63280967
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-morpholin-2-ylmethanamine
CID 63283712
N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-morpholin-2-ylmethanamine
CID 63838892
N-(2-methoxyethyl)-N'-methyl-N'-[(4-methyl-1,3-thiazol-5-yl)methyl]butane-1,4-diamine
CID 63838961
N-(2-methoxyethyl)-N'-methyl-N'-[(4-methyl-1,3-thiazol-5-yl)methyl]propane-1,3-diamine
CID 63838966

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide?
The IUPAC name of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide (CID 154789685) is 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide.
What is the SMILES notation for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide?
The canonical SMILES for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide is Cc1ncsc1CNS(=O)(=O)N1CCOC(C)(C)C1.
What is the InChIKey of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide?
The InChIKey is LUAPZUCGVYIWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S2/c1-9-10(18-8-12-9)6-13-19(15,16)14-4-5-17-11(2,3)7-14/h8,13H,4-7H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide?
2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide has a molecular weight of 305.43 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine-4-sulfonamide is sourced from PubChem (CID 154789685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).