2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide

C12H19N3O2S — CID 74235443

IUPAC2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide
SMILESCc1nc(C)c(CC(=O)NCC2CNCCO2)s1
InChIInChI=1S/C12H19N3O2S/c1-8-11(18-9(2)15-8)5-12(16)14-7-10-6-13-3-4-17-10/h10,13H,3-7H2,1-2H3,(H,14,16)
InChIKeyAARAFUSGZMTNHO-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.41
Rot. Bonds4

About 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide

2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide (PubChem CID 74235443) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide
PubChem CID74235443
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide
SMILESCc1nc(C)c(CC(=O)NCC2CNCCO2)s1
InChIInChI=1S/C12H19N3O2S/c1-8-11(18-9(2)15-8)5-12(16)14-7-10-6-13-3-4-17-10/h10,13H,3-7H2,1-2H3,(H,14,16)
InChIKeyAARAFUSGZMTNHO-UHFFFAOYSA-N
XLogP0.41
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide?
The IUPAC name of 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide (CID 74235443) is 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide is Cc1nc(C)c(CC(=O)NCC2CNCCO2)s1.
What is the InChIKey of 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide?
The InChIKey is AARAFUSGZMTNHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8-11(18-9(2)15-8)5-12(16)14-7-10-6-13-3-4-17-10/h10,13H,3-7H2,1-2H3,(H,14,16).
What are the key properties of 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide?
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide has a molecular weight of 269.37 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(morpholin-2-ylmethyl)acetamide is sourced from PubChem (CID 74235443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).