2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide

C8H12N2O2S — CID 115646854

IUPAC2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ccsc1=O
InChIInChI=1S/C8H12N2O2S/c1-2-3-9-7(11)6-10-4-5-13-8(10)12/h4-5H,2-3,6H2,1H3,(H,9,11)
InChIKeyRBAAVYHTPFOXKB-UHFFFAOYSA-N
MW200.26 g/mol
LogP0.44
Rot. Bonds4

About 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide

2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide (PubChem CID 115646854) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide
PubChem CID115646854
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC Name2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ccsc1=O
InChIInChI=1S/C8H12N2O2S/c1-2-3-9-7(11)6-10-4-5-13-8(10)12/h4-5H,2-3,6H2,1H3,(H,9,11)
InChIKeyRBAAVYHTPFOXKB-UHFFFAOYSA-N
XLogP0.44
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)acetamide
CID 177680509
N-[(1-ethenylazetidin-3-yl)methyl]-2-(4-hydroxy-2-oxo-1,3-thiazol-3-yl)acetamide
CID 123623147
N-(2,3-dihydro-1,3-thiazol-2-ylmethyl)propanamide
CID 129060250
2-(methylamino)-N-[3-methyl-1-oxo-1-(2H-1,3-thiazol-3-yl)butan-2-yl]propanamide
CID 141145133
(3-methyl-2H-1,3-thiazol-2-yl)-piperazin-1-ylmethanone
CID 146957017
2-(5-amino-2H-1,3-thiazol-3-yl)-N-ethylacetamide
CID 173431596
4-(Propan-2-yl)-2-[(propan-2-yl)amino]-2H-1,4-thiazin-3(4H)-one
CID 13117708
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-ethyl-2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetamide
CID 18145744
N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 18160775
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 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide?
The IUPAC name of 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide (CID 115646854) is 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide.
What is the SMILES notation for 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide?
The canonical SMILES for 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide is CCCNC(=O)Cn1ccsc1=O.
What is the InChIKey of 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide?
The InChIKey is RBAAVYHTPFOXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-2-3-9-7(11)6-10-4-5-13-8(10)12/h4-5H,2-3,6H2,1H3,(H,9,11).
What are the key properties of 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide?
2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide has a molecular weight of 200.26 g/mol, XLogP of 0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1,3-thiazol-3-yl)-N-propylacetamide is sourced from PubChem (CID 115646854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).