N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide

C11H15NO2S — CID 531782

IUPACN-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC1CCCO1
InChIInChI=1S/C11H15NO2S/c13-11(7-10-4-2-6-15-10)12-8-9-3-1-5-14-9/h2,4,6,9H,1,3,5,7-8H2,(H,12,13)
InChIKeyFBBGQQWNZLUCCK-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.59
Rot. Bonds4

About N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide

N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide (PubChem CID 531782) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide
PubChem CID531782
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC NameN-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC1CCCO1
InChIInChI=1S/C11H15NO2S/c13-11(7-10-4-2-6-15-10)12-8-9-3-1-5-14-9/h2,4,6,9H,1,3,5,7-8H2,(H,12,13)
InChIKeyFBBGQQWNZLUCCK-UHFFFAOYSA-N
XLogP1.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide (CID 531782) is N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide?
The InChIKey is FBBGQQWNZLUCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c13-11(7-10-4-2-6-15-10)12-8-9-3-1-5-14-9/h2,4,6,9H,1,3,5,7-8H2,(H,12,13).
What are the key properties of N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide?
N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide has a molecular weight of 225.31 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 531782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).