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

C9H14N2O2S — CID 115647614

IUPACN-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCC(C)(C)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C9H14N2O2S/c1-9(2,3)10-7(12)6-11-4-5-14-8(11)13/h4-5H,6H2,1-3H3,(H,10,12)
InChIKeyMFQIZAWXQXJALO-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.82
Rot. Bonds2

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

N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 115647614) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID115647614
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC NameN-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCC(C)(C)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C9H14N2O2S/c1-9(2,3)10-7(12)6-11-4-5-14-8(11)13/h4-5H,6H2,1-3H3,(H,10,12)
InChIKeyMFQIZAWXQXJALO-UHFFFAOYSA-N
XLogP0.82
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 16272650
4-(Propan-2-yl)-2-[(propan-2-yl)amino]-2H-1,4-thiazin-3(4H)-one
CID 13117708
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 18118143
N-ethyl-2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetamide
CID 18145744
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide
CID 27648160
N-tert-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 47111349
N-[2-(diethylamino)ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 47114435
N-ethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 47114567
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propylacetamide
CID 60656424
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-prop-2-enylacetamide
CID 60656426
2-[[2-(4-Methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetamide
CID 60693637
N-(3-amino-3-sulfanylidenepropyl)-N-methyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 63312400

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide (CID 115647614) is N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide is CC(C)(C)NC(=O)Cn1ccsc1=O.
What is the InChIKey of N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is MFQIZAWXQXJALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-9(2,3)10-7(12)6-11-4-5-14-8(11)13/h4-5H,6H2,1-3H3,(H,10,12).
What are the key properties of N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide?
N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 214.29 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 115647614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).