morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride

C13H19ClN2O3S — CID 119757292

IUPACmorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
SMILESCl.O=C(C1COCCN1)N1CCOC(c2cccs2)C1
InChIInChI=1S/C13H18N2O3S.ClH/c16-13(10-9-17-5-3-14-10)15-4-6-18-11(8-15)12-2-1-7-19-12;/h1-2,7,10-11,14H,3-6,8-9H2;1H
InChIKeySALLZWIRTQMOST-UHFFFAOYSA-N
MW318.83 g/mol
LogP1.06
Rot. Bonds2

About morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride

morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride (PubChem CID 119757292) has the molecular formula C13H19ClN2O3S and a molecular weight of 318.83 g/mol. Its IUPAC name is morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride.

Molecular Properties

Compound Namemorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
PubChem CID119757292
Molecular FormulaC13H19ClN2O3S
Molecular Weight318.83 g/mol
Exact Mass318.08
IUPAC Namemorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
SMILESCl.O=C(C1COCCN1)N1CCOC(c2cccs2)C1
InChIInChI=1S/C13H18N2O3S.ClH/c16-13(10-9-17-5-3-14-10)15-4-6-18-11(8-15)12-2-1-7-19-12;/h1-2,7,10-11,14H,3-6,8-9H2;1H
InChIKeySALLZWIRTQMOST-UHFFFAOYSA-N
XLogP1.06
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.83
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone
CID 119757293
(3-aminocyclopentyl)-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
CID 119757298
(3-amino-2-bicyclo[2.2.1]heptanyl)-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
CID 119757300
2-(methylamino)-1-(2-thiophen-2-ylmorpholin-4-yl)ethanone;hydrochloride
CID 119757306
(4S)-1-ethyl-4-[(2S)-2-thiophen-2-ylmorpholine-4-carbonyl]pyrrolidin-2-one
CID 97099734
2-amino-2-(4-methylphenyl)-1-(2-thiophen-2-ylmorpholin-4-yl)ethanone;hydrochloride
CID 120668000
[4-(aminomethyl)phenyl]-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride
CID 119308311
3,4-dihydro-1H-isoquinolin-2-yl(morpholin-3-yl)methanone;hydrochloride
CID 119669619
[(3R)-morpholin-3-yl]-piperazin-1-ylmethanone;hydrochloride
CID 130992240
[(3S)-3-hydroxypyrrolidin-1-yl]-[(3R)-morpholin-3-yl]methanone;hydrochloride
CID 130608601
3-piperidin-4-yl-1-(2-thiophen-2-ylmorpholin-4-yl)butan-1-one
CID 119757325
2-(cyclopropylmethylamino)-1-(2-thiophen-2-ylmorpholin-4-yl)ethanone
CID 119757315

Frequently Asked Questions

What is the IUPAC name of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride?
The IUPAC name of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride (CID 119757292) is morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride.
What is the SMILES notation for morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride?
The canonical SMILES for morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride is Cl.O=C(C1COCCN1)N1CCOC(c2cccs2)C1.
What is the InChIKey of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride?
The InChIKey is SALLZWIRTQMOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S.ClH/c16-13(10-9-17-5-3-14-10)15-4-6-18-11(8-15)12-2-1-7-19-12;/h1-2,7,10-11,14H,3-6,8-9H2;1H.
What are the key properties of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride?
morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride has a molecular weight of 318.83 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone;hydrochloride is sourced from PubChem (CID 119757292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).