2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide

C9H12N2O2S — CID 115287511

IUPAC2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NC1COC1)c1cccs1
InChIInChI=1S/C9H12N2O2S/c10-8(7-2-1-3-14-7)9(12)11-6-4-13-5-6/h1-3,6,8H,4-5,10H2,(H,11,12)
InChIKeyXUKBQKFFKYMTIH-UHFFFAOYSA-N
MW212.27 g/mol
LogP0.26
Rot. Bonds3

About 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide

2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide (PubChem CID 115287511) has the molecular formula C9H12N2O2S and a molecular weight of 212.27 g/mol. Its IUPAC name is 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide
PubChem CID115287511
Molecular FormulaC9H12N2O2S
Molecular Weight212.27 g/mol
Exact Mass212.06
IUPAC Name2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NC1COC1)c1cccs1
InChIInChI=1S/C9H12N2O2S/c10-8(7-2-1-3-14-7)9(12)11-6-4-13-5-6/h1-3,6,8H,4-5,10H2,(H,11,12)
InChIKeyXUKBQKFFKYMTIH-UHFFFAOYSA-N
XLogP0.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(oxan-3-yl)-2-thiophen-2-ylacetamide
CID 115287272
2-amino-N-(4-aminocyclohexyl)-2-thiophen-2-ylacetamide
CID 113279219
N-(1-acetylpiperidin-4-yl)-2-amino-2-thiophen-2-ylacetamide
CID 115286367
2-amino-N-(4-ethylcyclohexyl)-2-thiophen-2-ylacetamide
CID 115287059
3-[(2-amino-2-thiophen-2-ylacetyl)amino]cyclohexane-1-carboxylic acid
CID 115287229
2-amino-N-(6-oxopiperidin-3-yl)-2-thiophen-2-ylacetamide
CID 113279254
2-amino-2-thiophen-2-yl-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
CID 114096100
2-amino-N-(dicyclopropylmethyl)-2-thiophen-2-ylacetamide
CID 115286946
2-amino-N-(1-ethylsulfonylpiperidin-4-yl)-2-thiophen-2-ylacetamide
CID 115286975
ethyl 4-[(2-amino-2-thiophen-2-ylacetyl)amino]piperidine-1-carboxylate
CID 115285967
2-amino-N-(2,4-dimethylcyclohexyl)-2-thiophen-2-ylacetamide
CID 115287324
2-amino-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115285812

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide (CID 115287511) is 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide is NC(C(=O)NC1COC1)c1cccs1.
What is the InChIKey of 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide?
The InChIKey is XUKBQKFFKYMTIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2S/c10-8(7-2-1-3-14-7)9(12)11-6-4-13-5-6/h1-3,6,8H,4-5,10H2,(H,11,12).
What are the key properties of 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide?
2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide has a molecular weight of 212.27 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(oxetan-3-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 115287511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).