N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide

C13H16N2O3S — CID 109468234

IUPACN-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cc1csc(-c2ccoc2)n1
InChIInChI=1S/C13H16N2O3S/c1-2-15(4-5-16)12(17)7-11-9-19-13(14-11)10-3-6-18-8-10/h3,6,8-9,16H,2,4-5,7H2,1H3
InChIKeySBQGYGTUSRBOAE-UHFFFAOYSA-N
MW280.35 g/mol
LogP1.79
Rot. Bonds6

About N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide

N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide (PubChem CID 109468234) has the molecular formula C13H16N2O3S and a molecular weight of 280.35 g/mol. Its IUPAC name is N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide
PubChem CID109468234
Molecular FormulaC13H16N2O3S
Molecular Weight280.35 g/mol
Exact Mass280.09
IUPAC NameN-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cc1csc(-c2ccoc2)n1
InChIInChI=1S/C13H16N2O3S/c1-2-15(4-5-16)12(17)7-11-9-19-13(14-11)10-3-6-18-8-10/h3,6,8-9,16H,2,4-5,7H2,1H3
InChIKeySBQGYGTUSRBOAE-UHFFFAOYSA-N
XLogP1.79
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide (CID 109468234) is N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide is CCN(CCO)C(=O)Cc1csc(-c2ccoc2)n1.
What is the InChIKey of N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide?
The InChIKey is SBQGYGTUSRBOAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O3S/c1-2-15(4-5-16)12(17)7-11-9-19-13(14-11)10-3-6-18-8-10/h3,6,8-9,16H,2,4-5,7H2,1H3.
What are the key properties of N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide?
N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide has a molecular weight of 280.35 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(furan-3-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 109468234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).