N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide

C10H16N2OS — CID 676812

IUPACN-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc(C)c(C(C)(C)C)s1
InChIInChI=1S/C10H16N2OS/c1-6-8(10(3,4)5)14-9(11-6)12-7(2)13/h1-5H3,(H,11,12,13)
InChIKeyFYVVXDVXJGORDW-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.71
Rot. Bonds1

About N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide

N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 676812) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID676812
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc(C)c(C(C)(C)C)s1
InChIInChI=1S/C10H16N2OS/c1-6-8(10(3,4)5)14-9(11-6)12-7(2)13/h1-5H3,(H,11,12,13)
InChIKeyFYVVXDVXJGORDW-UHFFFAOYSA-N
XLogP2.71
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide (CID 676812) is N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide is CC(=O)Nc1nc(C)c(C(C)(C)C)s1.
What is the InChIKey of N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is FYVVXDVXJGORDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-6-8(10(3,4)5)14-9(11-6)12-7(2)13/h1-5H3,(H,11,12,13).
What are the key properties of N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide?
N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 212.32 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 676812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).