2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid

C11H16N2O4S — CID 82441955

IUPAC2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid
SMILESCOCc1nc(N2CCOCC2)sc1CC(=O)O
InChIInChI=1S/C11H16N2O4S/c1-16-7-8-9(6-10(14)15)18-11(12-8)13-2-4-17-5-3-13/h2-7H2,1H3,(H,14,15)
InChIKeyJEQYYHACSDZGPD-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.75
Rot. Bonds5

About 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid

2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid (PubChem CID 82441955) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid
PubChem CID82441955
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid
SMILESCOCc1nc(N2CCOCC2)sc1CC(=O)O
InChIInChI=1S/C11H16N2O4S/c1-16-7-8-9(6-10(14)15)18-11(12-8)13-2-4-17-5-3-13/h2-7H2,1H3,(H,14,15)
InChIKeyJEQYYHACSDZGPD-UHFFFAOYSA-N
XLogP0.75
TPSA71.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid?
The IUPAC name of 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid (CID 82441955) is 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid.
What is the SMILES notation for 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid?
The canonical SMILES for 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid is COCc1nc(N2CCOCC2)sc1CC(=O)O.
What is the InChIKey of 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid?
The InChIKey is JEQYYHACSDZGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-16-7-8-9(6-10(14)15)18-11(12-8)13-2-4-17-5-3-13/h2-7H2,1H3,(H,14,15).
What are the key properties of 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid?
2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid has a molecular weight of 272.33 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)-2-morpholin-4-yl-1,3-thiazol-5-yl]acetic acid is sourced from PubChem (CID 82441955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).