2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

C12H19N3O2S — CID 75413441

IUPAC2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NC(C(=O)NC1=NCCS1)C1CCCC1
InChIInChI=1S/C12H19N3O2S/c1-8(16)14-10(9-4-2-3-5-9)11(17)15-12-13-6-7-18-12/h9-10H,2-7H2,1H3,(H,14,16)(H,13,15,17)
InChIKeyPVNYPMAHWXERMT-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.90
Rot. Bonds3

About 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide

2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (PubChem CID 75413441) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
PubChem CID75413441
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)NC(C(=O)NC1=NCCS1)C1CCCC1
InChIInChI=1S/C12H19N3O2S/c1-8(16)14-10(9-4-2-3-5-9)11(17)15-12-13-6-7-18-12/h9-10H,2-7H2,1H3,(H,14,16)(H,13,15,17)
InChIKeyPVNYPMAHWXERMT-UHFFFAOYSA-N
XLogP0.90
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-acetamido-N-(4,5-dihydro-1,3-thiazol-2-yl)-3-methylbutanamide
CID 43008937
(2S)-2-acetamido-N-cyclooctyl-2-cyclopentylacetamide
CID 94491136
(2S)-2-acetamido-2-cyclopentyl-N-(1,3-thiazol-2-yl)acetamide
CID 25363384
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 108523407
2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
(2S)-2-acetamido-2-cyclopentylacetamide
CID 177134286
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
3-(4,5-dihydro-1,3-thiazol-2-ylamino)-4-methylpentan-2-one
CID 77342521
2-acetamido-2-cyclopentyl-N-(4-methylsulfonylphenyl)acetamide
CID 51272392
2-acetamido-2-cyclopentyl-N-(1-pyridin-4-ylethyl)acetamide
CID 86912436
(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide
CID 51562307
2-acetamido-2-cyclopentyl-N-(2,3-dichlorophenyl)acetamide
CID 51272483

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide (CID 75413441) is 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is CC(=O)NC(C(=O)NC1=NCCS1)C1CCCC1.
What is the InChIKey of 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
The InChIKey is PVNYPMAHWXERMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8(16)14-10(9-4-2-3-5-9)11(17)15-12-13-6-7-18-12/h9-10H,2-7H2,1H3,(H,14,16)(H,13,15,17).
What are the key properties of 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide?
2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide has a molecular weight of 269.37 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-2-cyclopentyl-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 75413441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).