N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide

C9H14N2O2S — CID 115659305

IUPACN-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)Cn1ccsc1=O
InChIInChI=1S/C9H14N2O2S/c1-7(2)10(3)8(12)6-11-4-5-14-9(11)13/h4-5,7H,6H2,1-3H3
InChIKeyBPPWXTASRFGLSS-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.78
Rot. Bonds3

About N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide

N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide (PubChem CID 115659305) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide
PubChem CID115659305
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC NameN-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)Cn1ccsc1=O
InChIInChI=1S/C9H14N2O2S/c1-7(2)10(3)8(12)6-11-4-5-14-9(11)13/h4-5,7H,6H2,1-3H3
InChIKeyBPPWXTASRFGLSS-UHFFFAOYSA-N
XLogP0.78
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-diethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 60665057
N,N-dimethyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 60692453
N-(2-cyanoethyl)-N-methyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 63312699
N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 78858380
2-(3-oxo-1,4-thiazin-4-yl)-N,N-dipropylacetamide
CID 84405886
N,N-dimethyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 115646827
N,N-diethyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 115646837
N-cyclopropyl-N-ethyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 115646843
2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide
CID 115646854
3-(2-Oxo-2-pyrrolidin-1-ylethyl)-1,3-thiazol-2-one
CID 115646863
N-cyclopropyl-N-methyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 115646885
N-tert-butyl-2-(2-oxo-1,3-thiazol-3-yl)acetamide
CID 115647614

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide?
The IUPAC name of N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide (CID 115659305) is N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide?
The canonical SMILES for N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide is CC(C)N(C)C(=O)Cn1ccsc1=O.
What is the InChIKey of N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide?
The InChIKey is BPPWXTASRFGLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-7(2)10(3)8(12)6-11-4-5-14-9(11)13/h4-5,7H,6H2,1-3H3.
What are the key properties of N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide?
N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide has a molecular weight of 214.29 g/mol, XLogP of 0.78, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 115659305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).