N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C11H18N2O3S — CID 113339494

IUPACN-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCN(CCCO)C(=O)Cn1c(C)csc1=O
InChIInChI=1S/C11H18N2O3S/c1-3-12(5-4-6-14)10(15)7-13-9(2)8-17-11(13)16/h8,14H,3-7H2,1-2H3
InChIKeyFJDLISOJJMRYPL-UHFFFAOYSA-N
MW258.34 g/mol
LogP0.45
Rot. Bonds6

About N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 113339494) has the molecular formula C11H18N2O3S and a molecular weight of 258.34 g/mol. Its IUPAC name is N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID113339494
Molecular FormulaC11H18N2O3S
Molecular Weight258.34 g/mol
Exact Mass258.10
IUPAC NameN-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCN(CCCO)C(=O)Cn1c(C)csc1=O
InChIInChI=1S/C11H18N2O3S/c1-3-12(5-4-6-14)10(15)7-13-9(2)8-17-11(13)16/h8,14H,3-7H2,1-2H3
InChIKeyFJDLISOJJMRYPL-UHFFFAOYSA-N
XLogP0.45
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 113339494) is N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is CCN(CCCO)C(=O)Cn1c(C)csc1=O.
What is the InChIKey of N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is FJDLISOJJMRYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-3-12(5-4-6-14)10(15)7-13-9(2)8-17-11(13)16/h8,14H,3-7H2,1-2H3.
What are the key properties of N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 258.34 g/mol, XLogP of 0.45, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-hydroxypropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 113339494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).