(5S)-5-aminopiperidin-2-one

C5H10N2O — CID 10942387

IUPAC(5S)-5-aminopiperidin-2-one
SMILESN[C@H]1CCC(=O)NC1
InChIInChI=1S/C5H10N2O/c6-4-1-2-5(8)7-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1
InChIKeyAPDCFRUAEFSNPV-BYPYZUCNSA-N
MW114.15 g/mol
LogP-0.78
Rot. Bonds

About (5S)-5-aminopiperidin-2-one

(5S)-5-aminopiperidin-2-one (PubChem CID 10942387) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is (5S)-5-aminopiperidin-2-one.

Molecular Properties

Compound Name(5S)-5-aminopiperidin-2-one
PubChem CID10942387
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name(5S)-5-aminopiperidin-2-one
SMILESN[C@H]1CCC(=O)NC1
InChIInChI=1S/C5H10N2O/c6-4-1-2-5(8)7-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1
InChIKeyAPDCFRUAEFSNPV-BYPYZUCNSA-N
XLogP-0.78
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-aminopiperidin-2-one?
The IUPAC name of (5S)-5-aminopiperidin-2-one (CID 10942387) is (5S)-5-aminopiperidin-2-one.
What is the SMILES notation for (5S)-5-aminopiperidin-2-one?
The canonical SMILES for (5S)-5-aminopiperidin-2-one is N[C@H]1CCC(=O)NC1.
What is the InChIKey of (5S)-5-aminopiperidin-2-one?
The InChIKey is APDCFRUAEFSNPV-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H10N2O/c6-4-1-2-5(8)7-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1.
What are the key properties of (5S)-5-aminopiperidin-2-one?
(5S)-5-aminopiperidin-2-one has a molecular weight of 114.15 g/mol, XLogP of -0.78, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-aminopiperidin-2-one is sourced from PubChem (CID 10942387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).