(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone

C11H15NO2S — CID 79077414

IUPAC(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone
SMILESCc1cc(C(=O)C2CN(C)CCO2)cs1
InChIInChI=1S/C11H15NO2S/c1-8-5-9(7-15-8)11(13)10-6-12(2)3-4-14-10/h5,7,10H,3-4,6H2,1-2H3
InChIKeyWHNJIZWXMAPJOH-UHFFFAOYSA-N
MW225.31 g/mol
LogP1.57
Rot. Bonds2

About (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone

(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone (PubChem CID 79077414) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone.

Molecular Properties

Compound Name(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone
PubChem CID79077414
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone
SMILESCc1cc(C(=O)C2CN(C)CCO2)cs1
InChIInChI=1S/C11H15NO2S/c1-8-5-9(7-15-8)11(13)10-6-12(2)3-4-14-10/h5,7,10H,3-4,6H2,1-2H3
InChIKeyWHNJIZWXMAPJOH-UHFFFAOYSA-N
XLogP1.57
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone?
The IUPAC name of (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone (CID 79077414) is (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone.
What is the SMILES notation for (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone?
The canonical SMILES for (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone is Cc1cc(C(=O)C2CN(C)CCO2)cs1.
What is the InChIKey of (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone?
The InChIKey is WHNJIZWXMAPJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-8-5-9(7-15-8)11(13)10-6-12(2)3-4-14-10/h5,7,10H,3-4,6H2,1-2H3.
What are the key properties of (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone?
(4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone has a molecular weight of 225.31 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-2-yl)-(5-methylthiophen-3-yl)methanone is sourced from PubChem (CID 79077414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).