N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide

C13H19N3O2S — CID 78886465

IUPACN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide
SMILESCCc1nc(NC(=O)CN2CCCCC2=O)sc1C
InChIInChI=1S/C13H19N3O2S/c1-3-10-9(2)19-13(14-10)15-11(17)8-16-7-5-4-6-12(16)18/h3-8H2,1-2H3,(H,14,15,17)
InChIKeyPRXSIWKODXKOFS-UHFFFAOYSA-N
MW281.38 g/mol
LogP1.96
Rot. Bonds4

About N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 78886465) has the molecular formula C13H19N3O2S and a molecular weight of 281.38 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID78886465
Molecular FormulaC13H19N3O2S
Molecular Weight281.38 g/mol
Exact Mass281.12
IUPAC NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide
SMILESCCc1nc(NC(=O)CN2CCCCC2=O)sc1C
InChIInChI=1S/C13H19N3O2S/c1-3-10-9(2)19-13(14-10)15-11(17)8-16-7-5-4-6-12(16)18/h3-8H2,1-2H3,(H,14,15,17)
InChIKeyPRXSIWKODXKOFS-UHFFFAOYSA-N
XLogP1.96
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-oxopiperidin-1-yl)acetamide
CID 78867878
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-oxopiperidin-1-yl)acetamide
CID 78861484
N-[4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]-2-(2-oxopiperidin-1-yl)acetamide;formic acid
CID 163340575
2-(2-oxopiperidin-1-yl)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 78864857
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)acetamide
CID 61471909
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2,4,5-trioxo-3-prop-2-enylimidazolidin-1-yl)acetamide
CID 51101012
N-benzo[e][1,3]benzothiazol-2-yl-2-(2-oxoazocan-1-yl)acetamide
CID 55755320
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(1-hydroxycyclopentyl)acetamide
CID 111430638
N-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-(2-oxopiperidin-1-yl)acetamide
CID 166245439
2-[4-[2-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60505092
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[(3S)-3-(2-methoxyethyl)azepan-1-yl]acetamide
CID 99784840
2-[3-(carbamoylamino)pyrrolidin-1-yl]-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)acetamide
CID 75435699

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide (CID 78886465) is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide is CCc1nc(NC(=O)CN2CCCCC2=O)sc1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is PRXSIWKODXKOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2S/c1-3-10-9(2)19-13(14-10)15-11(17)8-16-7-5-4-6-12(16)18/h3-8H2,1-2H3,(H,14,15,17).
What are the key properties of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide?
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 281.38 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 78886465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).