N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide

C10H16N2O2S — CID 115646840

IUPACN-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCC(C)C(C)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C10H16N2O2S/c1-7(2)8(3)11-9(13)6-12-4-5-15-10(12)14/h4-5,7-8H,6H2,1-3H3,(H,11,13)
InChIKeyXDPVWXDBJRPLFG-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.07
Rot. Bonds4

About N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide

N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 115646840) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID115646840
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC NameN-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCC(C)C(C)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C10H16N2O2S/c1-7(2)8(3)11-9(13)6-12-4-5-15-10(12)14/h4-5,7-8H,6H2,1-3H3,(H,11,13)
InChIKeyXDPVWXDBJRPLFG-UHFFFAOYSA-N
XLogP1.07
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide (CID 115646840) is N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide is CC(C)C(C)NC(=O)Cn1ccsc1=O.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is XDPVWXDBJRPLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-7(2)8(3)11-9(13)6-12-4-5-15-10(12)14/h4-5,7-8H,6H2,1-3H3,(H,11,13).
What are the key properties of N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 228.32 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-(2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 115646840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).