1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone

C10H18N2O3 — CID 79832857

IUPAC1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone
SMILESO=C(CN1CCOC(CO)C1)N1CCC1
InChIInChI=1S/C10H18N2O3/c13-8-9-6-11(4-5-15-9)7-10(14)12-2-1-3-12/h9,13H,1-8H2
InChIKeyZLDRRDKTUOUDTL-UHFFFAOYSA-N
MW214.26 g/mol
LogP-1.09
Rot. Bonds3

About 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone

1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone (PubChem CID 79832857) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone
PubChem CID79832857
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone
SMILESO=C(CN1CCOC(CO)C1)N1CCC1
InChIInChI=1S/C10H18N2O3/c13-8-9-6-11(4-5-15-9)7-10(14)12-2-1-3-12/h9,13H,1-8H2
InChIKeyZLDRRDKTUOUDTL-UHFFFAOYSA-N
XLogP-1.09
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone?
The IUPAC name of 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone (CID 79832857) is 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone?
The canonical SMILES for 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone is O=C(CN1CCOC(CO)C1)N1CCC1.
What is the InChIKey of 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone?
The InChIKey is ZLDRRDKTUOUDTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c13-8-9-6-11(4-5-15-9)7-10(14)12-2-1-3-12/h9,13H,1-8H2.
What are the key properties of 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone?
1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone has a molecular weight of 214.26 g/mol, XLogP of -1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 79832857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).