3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one

C14H26N2O3 — CID 111107028

IUPAC3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one
SMILESCC(O)C1CCCCN1CCC(=O)N1CCOCC1
InChIInChI=1S/C14H26N2O3/c1-12(17)13-4-2-3-6-15(13)7-5-14(18)16-8-10-19-11-9-16/h12-13,17H,2-11H2,1H3
InChIKeyDASWBODETNXVNE-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.47
Rot. Bonds4

About 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one

3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one (PubChem CID 111107028) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one
PubChem CID111107028
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one
SMILESCC(O)C1CCCCN1CCC(=O)N1CCOCC1
InChIInChI=1S/C14H26N2O3/c1-12(17)13-4-2-3-6-15(13)7-5-14(18)16-8-10-19-11-9-16/h12-13,17H,2-11H2,1H3
InChIKeyDASWBODETNXVNE-UHFFFAOYSA-N
XLogP0.47
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one (CID 111107028) is 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one is CC(O)C1CCCCN1CCC(=O)N1CCOCC1.
What is the InChIKey of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one?
The InChIKey is DASWBODETNXVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-12(17)13-4-2-3-6-15(13)7-5-14(18)16-8-10-19-11-9-16/h12-13,17H,2-11H2,1H3.
What are the key properties of 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one?
3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one has a molecular weight of 270.37 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1-hydroxyethyl)piperidin-1-yl]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 111107028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).