N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide

C12H16N2O3S — CID 110722581

IUPACN-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCN1CCOCC1=O
InChIInChI=1S/C12H16N2O3S/c15-11(8-10-2-1-7-18-10)13-3-4-14-5-6-17-9-12(14)16/h1-2,7H,3-6,8-9H2,(H,13,15)
InChIKeyMBXBWSBCIBZYGY-UHFFFAOYSA-N
MW268.34 g/mol
LogP0.27
Rot. Bonds5

About N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide

N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide (PubChem CID 110722581) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide
PubChem CID110722581
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC NameN-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCN1CCOCC1=O
InChIInChI=1S/C12H16N2O3S/c15-11(8-10-2-1-7-18-10)13-3-4-14-5-6-17-9-12(14)16/h1-2,7H,3-6,8-9H2,(H,13,15)
InChIKeyMBXBWSBCIBZYGY-UHFFFAOYSA-N
XLogP0.27
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649
N-[2-[(2-chloroacetyl)amino]ethyl]-2-thiophen-2-ylacetamide
CID 108573266
N-[2-(6,7-dihydro-4H-pyrano[3,4-d]pyrazol-1-yl)ethyl]-2-thiophen-2-ylacetamide
CID 90615113
N-[2-(3-oxomorpholin-4-yl)ethyl]pyridine-3-carboxamide
CID 110722595
N-(2-methyl-2-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide
CID 47005477
N-[2-(4-benzoylpiperazin-1-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110397782
3-(3-methylphenyl)-N-[2-(3-oxomorpholin-4-yl)ethyl]propanamide
CID 110722622
N-(3-pyrrol-1-ylpropyl)-2-thiophen-2-ylacetamide
CID 90500614
N-(3-piperazin-1-ylpropyl)-2-thiophen-2-ylacetamide;hydrochloride
CID 119393187
N-[2-(3-methylmorpholin-4-yl)sulfonylethyl]-2-thiophen-2-ylacetamide
CID 110345613
N-(2-imidazol-1-ylethyl)-2-thiophen-2-ylacetamide
CID 110472557
2-thiophen-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 1245174

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide (CID 110722581) is N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCCN1CCOCC1=O.
What is the InChIKey of N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide?
The InChIKey is MBXBWSBCIBZYGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c15-11(8-10-2-1-7-18-10)13-3-4-14-5-6-17-9-12(14)16/h1-2,7H,3-6,8-9H2,(H,13,15).
What are the key properties of N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide?
N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide has a molecular weight of 268.34 g/mol, XLogP of 0.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-oxomorpholin-4-yl)ethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 110722581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).