3-amino-1-(2-propoxyethyl)piperidine-2,6-dione

C10H18N2O3 — CID 106456413

IUPAC3-amino-1-(2-propoxyethyl)piperidine-2,6-dione
SMILESCCCOCCN1C(=O)CCC(N)C1=O
InChIInChI=1S/C10H18N2O3/c1-2-6-15-7-5-12-9(13)4-3-8(11)10(12)14/h8H,2-7,11H2,1H3
InChIKeyCEDONHHEBPUOQD-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.11
Rot. Bonds5

About 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione

3-amino-1-(2-propoxyethyl)piperidine-2,6-dione (PubChem CID 106456413) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione.

Molecular Properties

Compound Name3-amino-1-(2-propoxyethyl)piperidine-2,6-dione
PubChem CID106456413
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name3-amino-1-(2-propoxyethyl)piperidine-2,6-dione
SMILESCCCOCCN1C(=O)CCC(N)C1=O
InChIInChI=1S/C10H18N2O3/c1-2-6-15-7-5-12-9(13)4-3-8(11)10(12)14/h8H,2-7,11H2,1H3
InChIKeyCEDONHHEBPUOQD-UHFFFAOYSA-N
XLogP-0.11
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-amino-1-(2-pyrrolidin-1-ylethyl)piperidine-2,6-dione
CID 107913499
(3S)-3-amino-1-(2-methylpropyl)piperidine-2,6-dione
CID 39221101
(3R)-3-amino-1-methylpiperidine-2,6-dione;hydrobromide
CID 146401292
1-[2-(2-aminoethoxy)ethyl]-3-methylpyrrolidine-2,5-dione
CID 103482320
2-(6-amino-3,7-dioxo-2-propyldiazepan-1-yl)acetic acid
CID 18463926
2-(2-propoxyethyl)-3a,4,7,7a-tetrahydro-4,7-epoxyisoindole-1,3-dione
CID 137482807
3-(2-butoxyethyl)imidazolidine-2,4-dione
CID 103935917
1-(5-propoxypentyl)piperidin-4-one
CID 70277123
(3S)-3-amino-1-(pyridin-4-ylmethyl)piperidine-2,6-dione
CID 39221150
1-[2-[2-[2-[2-(2,5-dioxo-3-sulfanylpyrrolidin-1-yl)ethoxy]ethoxy]ethoxy]ethyl]-3-methylpyrrolidine-2,5-dione
CID 164585890
1,3-bis(2-propoxyethyl)imidazolidin-2-one
CID 139925751
8-(3-propoxypropyl)-8-azabicyclo[3.2.1]octan-3-one
CID 82946980

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione?
The IUPAC name of 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione (CID 106456413) is 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione.
What is the SMILES notation for 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione?
The canonical SMILES for 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione is CCCOCCN1C(=O)CCC(N)C1=O.
What is the InChIKey of 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione?
The InChIKey is CEDONHHEBPUOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-2-6-15-7-5-12-9(13)4-3-8(11)10(12)14/h8H,2-7,11H2,1H3.
What are the key properties of 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione?
3-amino-1-(2-propoxyethyl)piperidine-2,6-dione has a molecular weight of 214.26 g/mol, XLogP of -0.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-propoxyethyl)piperidine-2,6-dione is sourced from PubChem (CID 106456413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).