2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone

C13H25N3O2 — CID 43556595

IUPAC2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CN2CCC(N)CC2)CC(C)O1
InChIInChI=1S/C13H25N3O2/c1-10-7-16(8-11(2)18-10)13(17)9-15-5-3-12(14)4-6-15/h10-12H,3-9,14H2,1-2H3
InChIKeyNUFRKKHOAGWNES-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.05
Rot. Bonds2

About 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone

2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone (PubChem CID 43556595) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
PubChem CID43556595
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
SMILESCC1CN(C(=O)CN2CCC(N)CC2)CC(C)O1
InChIInChI=1S/C13H25N3O2/c1-10-7-16(8-11(2)18-10)13(17)9-15-5-3-12(14)4-6-15/h10-12H,3-9,14H2,1-2H3
InChIKeyNUFRKKHOAGWNES-UHFFFAOYSA-N
XLogP0.05
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,6-dimethylmorpholin-4-yl)-2-[4-(hydroxymethyl)piperidin-1-yl]ethanone
CID 60768713
1-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]piperidine-4-carbaldehyde
CID 62656806
2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylthiomorpholin-4-yl)ethanone
CID 79328119
1-(2,6-dimethylmorpholin-4-yl)-2-[4-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone
CID 60503561
1-(2,6-dimethylmorpholin-4-yl)-2-(3-hydroxyazetidin-1-yl)ethanone
CID 63282275
2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 61234450
2-(4-aminopiperidin-1-yl)-1-morpholin-4-ylethanone;dihydrochloride
CID 56773516
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]ethanone
CID 97047593
2-(4-aminopiperidin-1-yl)-1-(3-ethylpiperidin-1-yl)ethanone
CID 79327467
2-(4-aminopiperidin-1-yl)-1-[(3S)-3-hydroxypiperidin-1-yl]ethanone
CID 107222871
1-(2,6-dimethylmorpholin-4-yl)-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 102935864
1-(2,6-dimethylmorpholin-4-yl)-2-(4-phenylpiperazin-1-yl)ethanone
CID 78782485

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone (CID 43556595) is 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone is CC1CN(C(=O)CN2CCC(N)CC2)CC(C)O1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
The InChIKey is NUFRKKHOAGWNES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10-7-16(8-11(2)18-10)13(17)9-15-5-3-12(14)4-6-15/h10-12H,3-9,14H2,1-2H3.
What are the key properties of 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone?
2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone has a molecular weight of 255.36 g/mol, XLogP of 0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-1-(2,6-dimethylmorpholin-4-yl)ethanone is sourced from PubChem (CID 43556595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).