morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone

C14H25N3O5S — CID 3244399

IUPACmorpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone
SMILESO=C(C1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCOCC1
InChIInChI=1S/C14H25N3O5S/c18-14(15-5-9-21-10-6-15)13-1-3-16(4-2-13)23(19,20)17-7-11-22-12-8-17/h13H,1-12H2
InChIKeySGBAWYMDLFQVJN-UHFFFAOYSA-N
MW347.44 g/mol
LogP-0.87
Rot. Bonds3

About morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone

morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone (PubChem CID 3244399) has the molecular formula C14H25N3O5S and a molecular weight of 347.44 g/mol. Its IUPAC name is morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone
PubChem CID3244399
Molecular FormulaC14H25N3O5S
Molecular Weight347.44 g/mol
Exact Mass347.15
IUPAC Namemorpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone
SMILESO=C(C1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCOCC1
InChIInChI=1S/C14H25N3O5S/c18-14(15-5-9-21-10-6-15)13-1-3-16(4-2-13)23(19,20)17-7-11-22-12-8-17/h13H,1-12H2
InChIKeySGBAWYMDLFQVJN-UHFFFAOYSA-N
XLogP-0.87
TPSA79.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 5-0.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone?
The IUPAC name of morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone (CID 3244399) is morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone.
What is the SMILES notation for morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone?
The canonical SMILES for morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone is O=C(C1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone?
The InChIKey is SGBAWYMDLFQVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O5S/c18-14(15-5-9-21-10-6-15)13-1-3-16(4-2-13)23(19,20)17-7-11-22-12-8-17/h13H,1-12H2.
What are the key properties of morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone?
morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone has a molecular weight of 347.44 g/mol, XLogP of -0.87, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(1-morpholin-4-ylsulfonylpiperidin-4-yl)methanone is sourced from PubChem (CID 3244399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).