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

C13H18N2O3S — CID 119757293

IUPACmorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone
SMILESO=C(C1COCCN1)N1CCOC(c2cccs2)C1
InChIInChI=1S/C13H18N2O3S/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
InChIKeyJYINUVUBGICBGQ-UHFFFAOYSA-N
MW282.36 g/mol
LogP0.64
Rot. Bonds2

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

morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone (PubChem CID 119757293) has the molecular formula C13H18N2O3S and a molecular weight of 282.36 g/mol. Its IUPAC name is morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone.

Molecular Properties

Compound Namemorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone
PubChem CID119757293
Molecular FormulaC13H18N2O3S
Molecular Weight282.36 g/mol
Exact Mass282.10
IUPAC Namemorpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone
SMILESO=C(C1COCCN1)N1CCOC(c2cccs2)C1
InChIInChI=1S/C13H18N2O3S/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
InChIKeyJYINUVUBGICBGQ-UHFFFAOYSA-N
XLogP0.64
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone?
The IUPAC name of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone (CID 119757293) is morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone.
What is the SMILES notation for morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone?
The canonical SMILES for morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone is O=C(C1COCCN1)N1CCOC(c2cccs2)C1.
What is the InChIKey of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone?
The InChIKey is JYINUVUBGICBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/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.
What are the key properties of morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone?
morpholin-3-yl-(2-thiophen-2-ylmorpholin-4-yl)methanone has a molecular weight of 282.36 g/mol, XLogP of 0.64, 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 is sourced from PubChem (CID 119757293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).