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

C12H19N3O3S — CID 35353647

IUPAC3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide
SMILESCCCNC(=O)CNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C12H19N3O3S/c1-3-5-13-11(17)7-14-10(16)4-6-15-9(2)8-19-12(15)18/h8H,3-7H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyFWMAOHLPOWSRRA-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.25
Rot. Bonds7

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

3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide (PubChem CID 35353647) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide.

Molecular Properties

Compound Name3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide
PubChem CID35353647
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide
SMILESCCCNC(=O)CNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C12H19N3O3S/c1-3-5-13-11(17)7-14-10(16)4-6-15-9(2)8-19-12(15)18/h8H,3-7H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyFWMAOHLPOWSRRA-UHFFFAOYSA-N
XLogP0.25
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 16272650
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-cyclohexyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 4808442
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)acetamide
CID 177680509
N-(2,3-dihydro-1,3-thiazol-4-ylmethyl)-N-methylpropanamide
CID 129309953
n-Isobutyl-2-(4-methyl-2-oxothiazol-3(2h)-yl)acetamide
CID 16381129
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
CID 16384335
N-cyclopropyl-2-[4-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]piperazin-1-yl]acetamide
CID 17401099
N-(3-methylbutan-2-yl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
CID 17402743
N-(3-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 17461015

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide?
The IUPAC name of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide (CID 35353647) is 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide.
What is the SMILES notation for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide?
The canonical SMILES for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide is CCCNC(=O)CNC(=O)CCn1c(C)csc1=O.
What is the InChIKey of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide?
The InChIKey is FWMAOHLPOWSRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-3-5-13-11(17)7-14-10(16)4-6-15-9(2)8-19-12(15)18/h8H,3-7H2,1-2H3,(H,13,17)(H,14,16).
What are the key properties of 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide?
3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide has a molecular weight of 285.37 g/mol, XLogP of 0.25, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-[2-oxo-2-(propylamino)ethyl]propanamide is sourced from PubChem (CID 35353647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).