N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

C10H16N2O3S — CID 29198602

IUPACN-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCOCCNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C10H16N2O3S/c1-8-7-16-10(14)12(8)5-3-9(13)11-4-6-15-2/h7H,3-6H2,1-2H3,(H,11,13)
InChIKeyROFRQLXDIMBTNT-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.37
Rot. Bonds6

About N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide

N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (PubChem CID 29198602) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
PubChem CID29198602
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide
SMILESCOCCNC(=O)CCn1c(C)csc1=O
InChIInChI=1S/C10H16N2O3S/c1-8-7-16-10(14)12(8)5-3-9(13)11-4-6-15-2/h7H,3-6H2,1-2H3,(H,11,13)
InChIKeyROFRQLXDIMBTNT-UHFFFAOYSA-N
XLogP0.37
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The IUPAC name of N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide (CID 29198602) is N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is COCCNC(=O)CCn1c(C)csc1=O.
What is the InChIKey of N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
The InChIKey is ROFRQLXDIMBTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-8-7-16-10(14)12(8)5-3-9(13)11-4-6-15-2/h7H,3-6H2,1-2H3,(H,11,13).
What are the key properties of N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide?
N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide has a molecular weight of 244.32 g/mol, XLogP of 0.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanamide is sourced from PubChem (CID 29198602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).