N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

C9H14N2O2S — CID 47116325

IUPACN-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCCNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C9H14N2O2S/c1-3-10-8(12)4-5-11-7(2)6-14-9(11)13/h6H,3-5H2,1-2H3,(H,10,12)
InChIKeyDIZNRFWSHAEPLF-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.74
Rot. Bonds4

About N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (PubChem CID 47116325) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
PubChem CID47116325
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC NameN-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCCNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C9H14N2O2S/c1-3-10-8(12)4-5-11-7(2)6-14-9(11)13/h6H,3-5H2,1-2H3,(H,10,12)
InChIKeyDIZNRFWSHAEPLF-UHFFFAOYSA-N
XLogP0.74
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-2,2-difluoropropyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide;hydrochloride
CID 120408369
N-(3-amino-2,2-difluoropropyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 120408370
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 133865230
N-[2-(3-ethyl-2-oxo-1,3-thiazol-4-yl)ethyl]-2-fluoroprop-2-enamide
CID 166429886
N-cycloheptyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 4963584
3-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)propanamide
CID 177680058
N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
CID 129309953
2-(2-methyl-2,3-dihydro-1,3-thiazol-4-yl)-N-propan-2-ylacetamide
CID 130214752
N-(3-methylbutan-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 17402743
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-(3-oxo-3-pyrrolidin-1-ylpropyl)acetamide
CID 18157108
2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]-N-propylacetamide
CID 18162789

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The IUPAC name of N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (CID 47116325) is N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The canonical SMILES for N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is CCNC(=O)CCn1c(C)csc1=O.
What is the InChIKey of N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The InChIKey is DIZNRFWSHAEPLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-3-10-8(12)4-5-11-7(2)6-14-9(11)13/h6H,3-5H2,1-2H3,(H,10,12).
What are the key properties of N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide has a molecular weight of 214.29 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is sourced from PubChem (CID 47116325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).