2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone

C14H26N2O3 — CID 70906988

IUPAC2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone
SMILESCC1(C)CN(CC(=O)N2CCC(CO)CC2)CCO1
InChIInChI=1S/C14H26N2O3/c1-14(2)11-15(7-8-19-14)9-13(18)16-5-3-12(10-17)4-6-16/h12,17H,3-11H2,1-2H3
InChIKeyJBWYNCPLGZSMNW-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.33
Rot. Bonds3

About 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone

2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone (PubChem CID 70906988) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone
PubChem CID70906988
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone
SMILESCC1(C)CN(CC(=O)N2CCC(CO)CC2)CCO1
InChIInChI=1S/C14H26N2O3/c1-14(2)11-15(7-8-19-14)9-13(18)16-5-3-12(10-17)4-6-16/h12,17H,3-11H2,1-2H3
InChIKeyJBWYNCPLGZSMNW-UHFFFAOYSA-N
XLogP0.33
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone (CID 70906988) is 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone is CC1(C)CN(CC(=O)N2CCC(CO)CC2)CCO1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone?
The InChIKey is JBWYNCPLGZSMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-14(2)11-15(7-8-19-14)9-13(18)16-5-3-12(10-17)4-6-16/h12,17H,3-11H2,1-2H3.
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone?
2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone has a molecular weight of 270.37 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-1-[4-(hydroxymethyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 70906988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).