4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine

C10H15NO3S2 — CID 715044

IUPAC4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine
SMILESCc1cc(S(=O)(=O)N2CCOCC2)c(C)s1
InChIInChI=1S/C10H15NO3S2/c1-8-7-10(9(2)15-8)16(12,13)11-3-5-14-6-4-11/h7H,3-6H2,1-2H3
InChIKeyLEGHQVKUFCELJN-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.39
Rot. Bonds2

About 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine

4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine (PubChem CID 715044) has the molecular formula C10H15NO3S2 and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine.

Molecular Properties

Compound Name4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine
PubChem CID715044
Molecular FormulaC10H15NO3S2
Molecular Weight261.37 g/mol
Exact Mass261.05
IUPAC Name4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine
SMILESCc1cc(S(=O)(=O)N2CCOCC2)c(C)s1
InChIInChI=1S/C10H15NO3S2/c1-8-7-10(9(2)15-8)16(12,13)11-3-5-14-6-4-11/h7H,3-6H2,1-2H3
InChIKeyLEGHQVKUFCELJN-UHFFFAOYSA-N
XLogP1.39
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine?
The IUPAC name of 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine (CID 715044) is 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine.
What is the SMILES notation for 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine?
The canonical SMILES for 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine is Cc1cc(S(=O)(=O)N2CCOCC2)c(C)s1.
What is the InChIKey of 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine?
The InChIKey is LEGHQVKUFCELJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3S2/c1-8-7-10(9(2)15-8)16(12,13)11-3-5-14-6-4-11/h7H,3-6H2,1-2H3.
What are the key properties of 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine?
4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine has a molecular weight of 261.37 g/mol, XLogP of 1.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylthiophen-3-yl)sulfonylmorpholine is sourced from PubChem (CID 715044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).