morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone

C14H26N4O4S — CID 2982211

IUPACmorpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
SMILESO=C(N1CCOCC1)N1CCN(S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H26N4O4S/c19-14(16-10-12-22-13-11-16)15-6-8-18(9-7-15)23(20,21)17-4-2-1-3-5-17/h1-13H2
InChIKeySHFMIDSUESGTHU-UHFFFAOYSA-N
MW346.45 g/mol
LogP-0.21
Rot. Bonds2

About morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone

morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone (PubChem CID 2982211) has the molecular formula C14H26N4O4S and a molecular weight of 346.45 g/mol. Its IUPAC name is morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
PubChem CID2982211
Molecular FormulaC14H26N4O4S
Molecular Weight346.45 g/mol
Exact Mass346.17
IUPAC Namemorpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
SMILESO=C(N1CCOCC1)N1CCN(S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H26N4O4S/c19-14(16-10-12-22-13-11-16)15-6-8-18(9-7-15)23(20,21)17-4-2-1-3-5-17/h1-13H2
InChIKeySHFMIDSUESGTHU-UHFFFAOYSA-N
XLogP-0.21
TPSA73.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The IUPAC name of morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone (CID 2982211) is morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The canonical SMILES for morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone is O=C(N1CCOCC1)N1CCN(S(=O)(=O)N2CCCCC2)CC1.
What is the InChIKey of morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The InChIKey is SHFMIDSUESGTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O4S/c19-14(16-10-12-22-13-11-16)15-6-8-18(9-7-15)23(20,21)17-4-2-1-3-5-17/h1-13H2.
What are the key properties of morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone has a molecular weight of 346.45 g/mol, XLogP of -0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone is sourced from PubChem (CID 2982211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).