N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide

C10H16N2O2S — CID 24657102

IUPACN-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1nc(C(C)(C)C)cs1
InChIInChI=1S/C10H16N2O2S/c1-10(2,3)7-6-15-9(11-7)12-8(13)5-14-4/h6H,5H2,1-4H3,(H,11,12,13)
InChIKeyAENGWHDOVDIJTG-UHFFFAOYSA-N
MW228.32 g/mol
LogP2.03
Rot. Bonds3

About N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide

N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide (PubChem CID 24657102) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide
PubChem CID24657102
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1nc(C(C)(C)C)cs1
InChIInChI=1S/C10H16N2O2S/c1-10(2,3)7-6-15-9(11-7)12-8(13)5-14-4/h6H,5H2,1-4H3,(H,11,12,13)
InChIKeyAENGWHDOVDIJTG-UHFFFAOYSA-N
XLogP2.03
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide?
The IUPAC name of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide (CID 24657102) is N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide?
The canonical SMILES for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide is COCC(=O)Nc1nc(C(C)(C)C)cs1.
What is the InChIKey of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide?
The InChIKey is AENGWHDOVDIJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-10(2,3)7-6-15-9(11-7)12-8(13)5-14-4/h6H,5H2,1-4H3,(H,11,12,13).
What are the key properties of N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide?
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide has a molecular weight of 228.32 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butyl-1,3-thiazol-2-yl)-2-methoxyacetamide is sourced from PubChem (CID 24657102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).