(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone

C9H16N2O2S — CID 119276152

IUPAC(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone
SMILESCC1CN(C(=O)[C@H]2CSCN2)CCO1
InChIInChI=1S/C9H16N2O2S/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8/h7-8,10H,2-6H2,1H3/t7?,8-/m1/s1
InChIKeySNOKYZMLHZURQC-BRFYHDHCSA-N
MW216.31 g/mol
LogP-0.10
Rot. Bonds1

About (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone

(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone (PubChem CID 119276152) has the molecular formula C9H16N2O2S and a molecular weight of 216.31 g/mol. Its IUPAC name is (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone.

Molecular Properties

Compound Name(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone
PubChem CID119276152
Molecular FormulaC9H16N2O2S
Molecular Weight216.31 g/mol
Exact Mass216.09
IUPAC Name(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone
SMILESCC1CN(C(=O)[C@H]2CSCN2)CCO1
InChIInChI=1S/C9H16N2O2S/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8/h7-8,10H,2-6H2,1H3/t7?,8-/m1/s1
InChIKeySNOKYZMLHZURQC-BRFYHDHCSA-N
XLogP-0.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
CID 119276151
[2-(hydroxymethyl)morpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 119322366
[2-(hydroxymethyl)morpholin-4-yl]-(1,3-thiazolidin-4-yl)methanone;hydrochloride
CID 119322360
[2-(methoxymethyl)morpholin-4-yl]-(1,3-thiazolidin-4-yl)methanone;hydrochloride
CID 119328879
(2-methylmorpholin-4-yl)-[(2R)-piperidin-2-yl]methanone;hydrochloride
CID 119698701
[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-[(4R)-1,3-thiazolidin-4-yl]methanone
CID 124591656
4-(thiomorpholine-3-carbonyl)morpholine-2-carboxylic acid
CID 82908492
[3-(diethylamino)pyrrolidin-1-yl]-(1,3-thiazolidin-4-yl)methanone
CID 63166761
1-(1,3-thiazolidine-4-carbonyl)azetidine-3-carboxylic acid
CID 79310155
[4-[(4-propan-2-ylmorpholin-2-yl)methyl]piperazin-1-yl]-(1,3-thiazolidin-4-yl)methanone
CID 119903128
[(2R,6S)-2-(4-fluorophenyl)-6-methylmorpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 124697908
[4-(dimethylamino)piperidin-1-yl]-(1,3-thiazolidin-4-yl)methanone;dihydrochloride
CID 119958530

Frequently Asked Questions

What is the IUPAC name of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone?
The IUPAC name of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone (CID 119276152) is (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone.
What is the SMILES notation for (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone?
The canonical SMILES for (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone is CC1CN(C(=O)[C@H]2CSCN2)CCO1.
What is the InChIKey of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone?
The InChIKey is SNOKYZMLHZURQC-BRFYHDHCSA-N. The full InChI is InChI=1S/C9H16N2O2S/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8/h7-8,10H,2-6H2,1H3/t7?,8-/m1/s1.
What are the key properties of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone?
(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone has a molecular weight of 216.31 g/mol, XLogP of -0.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone is sourced from PubChem (CID 119276152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).