N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide

C11H17NO2S — CID 43572999

IUPACN-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide
SMILESCC(C)N(CCO)C(=O)Cc1ccsc1
InChIInChI=1S/C11H17NO2S/c1-9(2)12(4-5-13)11(14)7-10-3-6-15-8-10/h3,6,8-9,13H,4-5,7H2,1-2H3
InChIKeyIINODWYXGFUFST-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.52
Rot. Bonds5

About N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide

N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide (PubChem CID 43572999) has the molecular formula C11H17NO2S and a molecular weight of 227.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide
PubChem CID43572999
Molecular FormulaC11H17NO2S
Molecular Weight227.33 g/mol
Exact Mass227.10
IUPAC NameN-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide
SMILESCC(C)N(CCO)C(=O)Cc1ccsc1
InChIInChI=1S/C11H17NO2S/c1-9(2)12(4-5-13)11(14)7-10-3-6-15-8-10/h3,6,8-9,13H,4-5,7H2,1-2H3
InChIKeyIINODWYXGFUFST-UHFFFAOYSA-N
XLogP1.52
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide?
The IUPAC name of N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide (CID 43572999) is N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide is CC(C)N(CCO)C(=O)Cc1ccsc1.
What is the InChIKey of N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide?
The InChIKey is IINODWYXGFUFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S/c1-9(2)12(4-5-13)11(14)7-10-3-6-15-8-10/h3,6,8-9,13H,4-5,7H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide?
N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide has a molecular weight of 227.33 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-propan-2-yl-2-thiophen-3-ylacetamide is sourced from PubChem (CID 43572999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).