2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid

C11H18N2O4S — CID 66426625

IUPAC2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid
SMILESCC1SCC(C(=O)O)N1C(=O)CC1CNCCO1
InChIInChI=1S/C11H18N2O4S/c1-7-13(9(6-18-7)11(15)16)10(14)4-8-5-12-2-3-17-8/h7-9,12H,2-6H2,1H3,(H,15,16)
InChIKeyFOYNPKSKJKSHCP-UHFFFAOYSA-N
MW274.34 g/mol
LogP-0.26
Rot. Bonds3

About 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid

2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid (PubChem CID 66426625) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid.

Molecular Properties

Compound Name2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid
PubChem CID66426625
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC Name2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid
SMILESCC1SCC(C(=O)O)N1C(=O)CC1CNCCO1
InChIInChI=1S/C11H18N2O4S/c1-7-13(9(6-18-7)11(15)16)10(14)4-8-5-12-2-3-17-8/h7-9,12H,2-6H2,1H3,(H,15,16)
InChIKeyFOYNPKSKJKSHCP-UHFFFAOYSA-N
XLogP-0.26
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-(2-morpholin-2-ylacetyl)piperidine-2-carboxylic acid
CID 107068760
3-(2-cyclobutylacetyl)-2-methyl-1,3-thiazolidine-4-carboxylic acid
CID 103161930
2-methyl-3-(piperidine-4-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 55235129
3-methyl-4-(2-morpholin-2-ylacetyl)piperazin-2-one;hydrochloride
CID 119760161
1-morpholin-2-ylbutan-2-one
CID 116586154
1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-morpholin-2-ylethanone
CID 66426413
2-morpholin-2-yl-1-(2,3,5-trimethylpiperidin-1-yl)ethanone
CID 114593052
2-[4-(2-morpholin-2-ylacetyl)thiomorpholin-3-yl]acetic acid
CID 66428343
2-morpholin-2-yl-1-thiomorpholin-4-ylethanone
CID 66434733
2-methyl-3-(3-piperidin-4-yloxypropanoyl)-1,3-thiazolidine-4-carboxylic acid
CID 63903192
1-(azepan-1-yl)-2-morpholin-2-ylethanone
CID 66433560
1-(2-methyl-1,4-oxazepan-4-yl)-2-morpholin-2-ylethanone;hydrochloride
CID 119771962

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid?
The IUPAC name of 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid (CID 66426625) is 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid.
What is the SMILES notation for 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid?
The canonical SMILES for 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid is CC1SCC(C(=O)O)N1C(=O)CC1CNCCO1.
What is the InChIKey of 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid?
The InChIKey is FOYNPKSKJKSHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-7-13(9(6-18-7)11(15)16)10(14)4-8-5-12-2-3-17-8/h7-9,12H,2-6H2,1H3,(H,15,16).
What are the key properties of 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid?
2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid has a molecular weight of 274.34 g/mol, XLogP of -0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-morpholin-2-ylacetyl)-1,3-thiazolidine-4-carboxylic acid is sourced from PubChem (CID 66426625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).