morpholin-4-yl(oxetan-2-yl)methanone

C8H13NO3 — CID 130874953

IUPACmorpholin-4-yl(oxetan-2-yl)methanone
SMILESO=C(C1CCO1)N1CCOCC1
InChIInChI=1S/C8H13NO3/c10-8(7-1-4-12-7)9-2-5-11-6-3-9/h7H,1-6H2
InChIKeyPQNBSCISYPISCK-UHFFFAOYSA-N
MW171.20 g/mol
LogP-0.37
Rot. Bonds1

About morpholin-4-yl(oxetan-2-yl)methanone

morpholin-4-yl(oxetan-2-yl)methanone (PubChem CID 130874953) has the molecular formula C8H13NO3 and a molecular weight of 171.20 g/mol. Its IUPAC name is morpholin-4-yl(oxetan-2-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl(oxetan-2-yl)methanone
PubChem CID130874953
Molecular FormulaC8H13NO3
Molecular Weight171.20 g/mol
Exact Mass171.09
IUPAC Namemorpholin-4-yl(oxetan-2-yl)methanone
SMILESO=C(C1CCO1)N1CCOCC1
InChIInChI=1S/C8H13NO3/c10-8(7-1-4-12-7)9-2-5-11-6-3-9/h7H,1-6H2
InChIKeyPQNBSCISYPISCK-UHFFFAOYSA-N
XLogP-0.37
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-0.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(oxetan-2-yl)methanone?
The IUPAC name of morpholin-4-yl(oxetan-2-yl)methanone (CID 130874953) is morpholin-4-yl(oxetan-2-yl)methanone.
What is the SMILES notation for morpholin-4-yl(oxetan-2-yl)methanone?
The canonical SMILES for morpholin-4-yl(oxetan-2-yl)methanone is O=C(C1CCO1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(oxetan-2-yl)methanone?
The InChIKey is PQNBSCISYPISCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO3/c10-8(7-1-4-12-7)9-2-5-11-6-3-9/h7H,1-6H2.
What are the key properties of morpholin-4-yl(oxetan-2-yl)methanone?
morpholin-4-yl(oxetan-2-yl)methanone has a molecular weight of 171.20 g/mol, XLogP of -0.37, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(oxetan-2-yl)methanone is sourced from PubChem (CID 130874953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).