N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C11H18N2O4S — CID 114243353

IUPACN-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)N(C)CCOCCO
InChIInChI=1S/C11H18N2O4S/c1-9-8-18-11(16)13(9)7-10(15)12(2)3-5-17-6-4-14/h8,14H,3-7H2,1-2H3
InChIKeyOHKWMSGULDNZIY-UHFFFAOYSA-N
MW274.34 g/mol
LogP-0.31
Rot. Bonds7

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

N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 114243353) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID114243353
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC NameN-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)N(C)CCOCCO
InChIInChI=1S/C11H18N2O4S/c1-9-8-18-11(16)13(9)7-10(15)12(2)3-5-17-6-4-14/h8,14H,3-7H2,1-2H3
InChIKeyOHKWMSGULDNZIY-UHFFFAOYSA-N
XLogP-0.31
TPSA71.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[2-[4-(2-Hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-4-methyl-1,3-thiazol-2-one
CID 43415622
N-(2-hydroxyethyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-propan-2-ylacetamide
CID 43573736
Ethyl 2-[ethyl-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetate
CID 54900567
N-(2-hydroxy-3-methoxypropyl)-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 54993492
N-(2-hydroxyethyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-pentan-3-ylacetamide
CID 54994616
Ethyl 2-[methyl-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetate
CID 55008334
Ethyl 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]-propylamino]acetate
CID 61007718
Ethyl 2-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]-propan-2-ylamino]acetate
CID 61021434
3-[2-(2-Hydroxyethoxy)ethyl]-4-methyl-1,3-thiazol-2-one
CID 61070159
N,N-bis(2-hydroxyethyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 61236222
2-[2-Methoxyethyl-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]acetic acid
CID 61537186
N-(2-hydroxypropyl)-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 62334254

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 114243353) is N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is Cc1csc(=O)n1CC(=O)N(C)CCOCCO.
What is the InChIKey of N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is OHKWMSGULDNZIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-9-8-18-11(16)13(9)7-10(15)12(2)3-5-17-6-4-14/h8,14H,3-7H2,1-2H3.
What are the key properties of N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 274.34 g/mol, XLogP of -0.31, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethoxy)ethyl]-N-methyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 114243353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).