1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione

C11H20N2O3 — CID 104594518

IUPAC1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione
SMILESCC(O)CNCCN1C(=O)CC(C)CC1=O
InChIInChI=1S/C11H20N2O3/c1-8-5-10(15)13(11(16)6-8)4-3-12-7-9(2)14/h8-9,12,14H,3-7H2,1-2H3
InChIKeyLEUNOISCJYMRSH-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.26
Rot. Bonds5

About 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione

1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione (PubChem CID 104594518) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Name1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione
PubChem CID104594518
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione
SMILESCC(O)CNCCN1C(=O)CC(C)CC1=O
InChIInChI=1S/C11H20N2O3/c1-8-5-10(15)13(11(16)6-8)4-3-12-7-9(2)14/h8-9,12,14H,3-7H2,1-2H3
InChIKeyLEUNOISCJYMRSH-UHFFFAOYSA-N
XLogP-0.26
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
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

8-[2-(2-hydroxypropylamino)ethyl]-8-azaspiro[4.5]decane-7,9-dione
CID 104594510
1-[2-(2-methoxyethylamino)ethyl]-4-methylpiperidine-2,6-dione
CID 83030099
1-[2-(2-hydroxypropylamino)ethyl]-5-oxopyrrolidine-3-carboxylic acid
CID 168690171
1-[2-hydroxy-3-(methylamino)propyl]-4-methylpiperidine-2,6-dione
CID 79507028
1-(4-hydroxyhexyl)-4-methylpiperidine-2,6-dione
CID 106802582
[1-[2-(2-hydroxypropylamino)ethyl]-5-oxopyrrolidin-3-yl]methanesulfonyl fluoride
CID 168674730
4-methyl-1-[4-(propylamino)pentyl]piperidine-2,6-dione
CID 79506055
methyl 3-(4-methyl-2,6-dioxopiperidin-1-yl)propanoate
CID 79506636
1-(3-aminopropyl)-4-methylpiperidine-2,6-dione
CID 62932770
2-methyl-3-(4-methyl-2,6-dioxopiperidin-1-yl)propanoic acid
CID 62933969
1-[2-(azepan-1-yl)ethylamino]propan-2-ol
CID 104594544
1-(2-hydroxypentyl)-4-methylpiperidine-2,6-dione
CID 79506655

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione?
The IUPAC name of 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione (CID 104594518) is 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione.
What is the SMILES notation for 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione?
The canonical SMILES for 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione is CC(O)CNCCN1C(=O)CC(C)CC1=O.
What is the InChIKey of 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione?
The InChIKey is LEUNOISCJYMRSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8-5-10(15)13(11(16)6-8)4-3-12-7-9(2)14/h8-9,12,14H,3-7H2,1-2H3.
What are the key properties of 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione?
1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione has a molecular weight of 228.29 g/mol, XLogP of -0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxypropylamino)ethyl]-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 104594518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).