4-amino-5-hydroxypiperidin-2-one

C5H10N2O2 — CID 131579230

IUPAC4-amino-5-hydroxypiperidin-2-one
SMILESNC1CC(=O)NCC1O
InChIInChI=1S/C5H10N2O2/c6-3-1-5(9)7-2-4(3)8/h3-4,8H,1-2,6H2,(H,7,9)
InChIKeyVMLGRFJIOPWFKM-UHFFFAOYSA-N
MW130.15 g/mol
LogP-1.81
Rot. Bonds

About 4-amino-5-hydroxypiperidin-2-one

4-amino-5-hydroxypiperidin-2-one (PubChem CID 131579230) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 4-amino-5-hydroxypiperidin-2-one.

Molecular Properties

Compound Name4-amino-5-hydroxypiperidin-2-one
PubChem CID131579230
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name4-amino-5-hydroxypiperidin-2-one
SMILESNC1CC(=O)NCC1O
InChIInChI=1S/C5H10N2O2/c6-3-1-5(9)7-2-4(3)8/h3-4,8H,1-2,6H2,(H,7,9)
InChIKeyVMLGRFJIOPWFKM-UHFFFAOYSA-N
XLogP-1.81
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-hydroxypiperidin-2-one?
The IUPAC name of 4-amino-5-hydroxypiperidin-2-one (CID 131579230) is 4-amino-5-hydroxypiperidin-2-one.
What is the SMILES notation for 4-amino-5-hydroxypiperidin-2-one?
The canonical SMILES for 4-amino-5-hydroxypiperidin-2-one is NC1CC(=O)NCC1O.
What is the InChIKey of 4-amino-5-hydroxypiperidin-2-one?
The InChIKey is VMLGRFJIOPWFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c6-3-1-5(9)7-2-4(3)8/h3-4,8H,1-2,6H2,(H,7,9).
What are the key properties of 4-amino-5-hydroxypiperidin-2-one?
4-amino-5-hydroxypiperidin-2-one has a molecular weight of 130.15 g/mol, XLogP of -1.81, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-hydroxypiperidin-2-one is sourced from PubChem (CID 131579230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).