(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one

C5H10N2O3 — CID 14888092

IUPAC(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one
SMILESN[C@H]1C(=O)NC[C@@H](O)[C@@H]1O
InChIInChI=1S/C5H10N2O3/c6-3-4(9)2(8)1-7-5(3)10/h2-4,8-9H,1,6H2,(H,7,10)/t2-,3-,4+/m1/s1
InChIKeyHCHNBOFMNHKJPL-JJYYJPOSSA-N
MW146.15 g/mol
LogP-2.83
Rot. Bonds

About (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one

(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one (PubChem CID 14888092) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one.

Molecular Properties

Compound Name(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one
PubChem CID14888092
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one
SMILESN[C@H]1C(=O)NC[C@@H](O)[C@@H]1O
InChIInChI=1S/C5H10N2O3/c6-3-4(9)2(8)1-7-5(3)10/h2-4,8-9H,1,6H2,(H,7,10)/t2-,3-,4+/m1/s1
InChIKeyHCHNBOFMNHKJPL-JJYYJPOSSA-N
XLogP-2.83
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-2.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one?
The IUPAC name of (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one (CID 14888092) is (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one.
What is the SMILES notation for (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one?
The canonical SMILES for (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one is N[C@H]1C(=O)NC[C@@H](O)[C@@H]1O.
What is the InChIKey of (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one?
The InChIKey is HCHNBOFMNHKJPL-JJYYJPOSSA-N. The full InChI is InChI=1S/C5H10N2O3/c6-3-4(9)2(8)1-7-5(3)10/h2-4,8-9H,1,6H2,(H,7,10)/t2-,3-,4+/m1/s1.
What are the key properties of (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one?
(3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one has a molecular weight of 146.15 g/mol, XLogP of -2.83, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R,5R)-3-amino-4,5-dihydroxypiperidin-2-one is sourced from PubChem (CID 14888092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).