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

C9H17ClN2O2S — CID 119276151

IUPAC(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
SMILESCC1CN(C(=O)[C@H]2CSCN2)CCO1.Cl
InChIInChI=1S/C9H16N2O2S.ClH/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8;/h7-8,10H,2-6H2,1H3;1H/t7?,8-;/m1./s1
InChIKeySYFNUNYSQOZTJS-LTTWWRRRSA-N
MW252.77 g/mol
LogP0.32
Rot. Bonds1

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

(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride (PubChem CID 119276151) has the molecular formula C9H17ClN2O2S and a molecular weight of 252.77 g/mol. Its IUPAC name is (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride.

Molecular Properties

Compound Name(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
PubChem CID119276151
Molecular FormulaC9H17ClN2O2S
Molecular Weight252.77 g/mol
Exact Mass252.07
IUPAC Name(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
SMILESCC1CN(C(=O)[C@H]2CSCN2)CCO1.Cl
InChIInChI=1S/C9H16N2O2S.ClH/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8;/h7-8,10H,2-6H2,1H3;1H/t7?,8-;/m1./s1
InChIKeySYFNUNYSQOZTJS-LTTWWRRRSA-N
XLogP0.32
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.77
LogP ≤ 50.32
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
CID 119276152
[2-(hydroxymethyl)morpholin-4-yl]-(1,3-thiazolidin-4-yl)methanone;hydrochloride
CID 119322360
[2-(hydroxymethyl)morpholin-4-yl]-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 119322366
[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
(2-methylthiomorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone
CID 119318083
[4-(dimethylamino)piperidin-1-yl]-(1,3-thiazolidin-4-yl)methanone;dihydrochloride
CID 119958530
(3,3-dimethylpyrrolidin-1-yl)-(1,3-thiazolidin-4-yl)methanone;hydrochloride
CID 119322655
(4-aminopiperidin-1-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
CID 131101939
[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-[(4R)-1,3-thiazolidin-4-yl]methanone
CID 124591656
(4-methoxypiperidin-1-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
CID 119275333
[3-(methoxymethyl)piperidin-1-yl]-(1,3-thiazolidin-4-yl)methanone;hydrochloride
CID 119322524

Frequently Asked Questions

What is the IUPAC name of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride?
The IUPAC name of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride (CID 119276151) is (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride.
What is the SMILES notation for (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride?
The canonical SMILES for (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride is CC1CN(C(=O)[C@H]2CSCN2)CCO1.Cl.
What is the InChIKey of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride?
The InChIKey is SYFNUNYSQOZTJS-LTTWWRRRSA-N. The full InChI is InChI=1S/C9H16N2O2S.ClH/c1-7-4-11(2-3-13-7)9(12)8-5-14-6-10-8;/h7-8,10H,2-6H2,1H3;1H/t7?,8-;/m1./s1.
What are the key properties of (2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride?
(2-methylmorpholin-4-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride has a molecular weight of 252.77 g/mol, XLogP of 0.32, 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;hydrochloride is sourced from PubChem (CID 119276151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).