2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone

C15H22N2O4S2 — CID 53067996

IUPAC2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCCCC1
InChIInChI=1S/C15H22N2O4S2/c18-14(16-6-2-1-3-7-16)12-13-4-5-15(22-13)23(19,20)17-8-10-21-11-9-17/h4-5H,1-3,6-12H2
InChIKeyRQZWIQBCLWRZTO-UHFFFAOYSA-N
MW358.49 g/mol
LogP1.32
Rot. Bonds4

About 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone

2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone (PubChem CID 53067996) has the molecular formula C15H22N2O4S2 and a molecular weight of 358.49 g/mol. Its IUPAC name is 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone
PubChem CID53067996
Molecular FormulaC15H22N2O4S2
Molecular Weight358.49 g/mol
Exact Mass358.10
IUPAC Name2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCCCC1
InChIInChI=1S/C15H22N2O4S2/c18-14(16-6-2-1-3-7-16)12-13-4-5-15(22-13)23(19,20)17-8-10-21-11-9-17/h4-5H,1-3,6-12H2
InChIKeyRQZWIQBCLWRZTO-UHFFFAOYSA-N
XLogP1.32
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone?
The IUPAC name of 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone (CID 53067996) is 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone?
The canonical SMILES for 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone is O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)N1CCCCC1.
What is the InChIKey of 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone?
The InChIKey is RQZWIQBCLWRZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4S2/c18-14(16-6-2-1-3-7-16)12-13-4-5-15(22-13)23(19,20)17-8-10-21-11-9-17/h4-5H,1-3,6-12H2.
What are the key properties of 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone?
2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone has a molecular weight of 358.49 g/mol, XLogP of 1.32, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)-1-piperidin-1-ylethanone is sourced from PubChem (CID 53067996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).