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

C10H16N2O2S — CID 115659307

IUPAC2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C10H16N2O2S/c1-3-8(4-2)11-9(13)7-12-5-6-15-10(12)14/h5-6,8H,3-4,7H2,1-2H3,(H,11,13)
InChIKeyYACBJEGNPZDGNA-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.21
Rot. Bonds5

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

2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide (PubChem CID 115659307) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
PubChem CID115659307
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)Cn1ccsc1=O
InChIInChI=1S/C10H16N2O2S/c1-3-8(4-2)11-9(13)7-12-5-6-15-10(12)14/h5-6,8H,3-4,7H2,1-2H3,(H,11,13)
InChIKeyYACBJEGNPZDGNA-UHFFFAOYSA-N
XLogP1.21
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-3-ethenylsulfanyl-N,N-diethyl-2-(propanoylamino)propanamide
CID 134569862
2-(methylamino)-N-[3-methyl-1-oxo-1-(2H-1,3-thiazol-3-yl)butan-2-yl]propanamide
CID 141145133
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-(3-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 17461015
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
N-cyclopropyl-2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetamide
CID 18163771
N-[(2R)-3-methylbutan-2-yl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 25980907
N-[(2S)-3-methylbutan-2-yl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 25980908

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide?
The IUPAC name of 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide (CID 115659307) is 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide?
The canonical SMILES for 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide is CCC(CC)NC(=O)Cn1ccsc1=O.
What is the InChIKey of 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide?
The InChIKey is YACBJEGNPZDGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-3-8(4-2)11-9(13)7-12-5-6-15-10(12)14/h5-6,8H,3-4,7H2,1-2H3,(H,11,13).
What are the key properties of 2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide?
2-(2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide has a molecular weight of 228.32 g/mol, XLogP of 1.21, 5 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-pentan-3-ylacetamide is sourced from PubChem (CID 115659307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).