5-(oxetan-3-ylamino)piperidin-2-one

C8H14N2O2 — CID 63661229

IUPAC5-(oxetan-3-ylamino)piperidin-2-one
SMILESO=C1CCC(NC2COC2)CN1
InChIInChI=1S/C8H14N2O2/c11-8-2-1-6(3-9-8)10-7-4-12-5-7/h6-7,10H,1-5H2,(H,9,11)
InChIKeyHLNFOEDEUMWNLL-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.75
Rot. Bonds2

About 5-(oxetan-3-ylamino)piperidin-2-one

5-(oxetan-3-ylamino)piperidin-2-one (PubChem CID 63661229) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 5-(oxetan-3-ylamino)piperidin-2-one.

Molecular Properties

Compound Name5-(oxetan-3-ylamino)piperidin-2-one
PubChem CID63661229
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name5-(oxetan-3-ylamino)piperidin-2-one
SMILESO=C1CCC(NC2COC2)CN1
InChIInChI=1S/C8H14N2O2/c11-8-2-1-6(3-9-8)10-7-4-12-5-7/h6-7,10H,1-5H2,(H,9,11)
InChIKeyHLNFOEDEUMWNLL-UHFFFAOYSA-N
XLogP-0.75
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(oxetan-3-ylamino)piperidin-2-one?
The IUPAC name of 5-(oxetan-3-ylamino)piperidin-2-one (CID 63661229) is 5-(oxetan-3-ylamino)piperidin-2-one.
What is the SMILES notation for 5-(oxetan-3-ylamino)piperidin-2-one?
The canonical SMILES for 5-(oxetan-3-ylamino)piperidin-2-one is O=C1CCC(NC2COC2)CN1.
What is the InChIKey of 5-(oxetan-3-ylamino)piperidin-2-one?
The InChIKey is HLNFOEDEUMWNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c11-8-2-1-6(3-9-8)10-7-4-12-5-7/h6-7,10H,1-5H2,(H,9,11).
What are the key properties of 5-(oxetan-3-ylamino)piperidin-2-one?
5-(oxetan-3-ylamino)piperidin-2-one has a molecular weight of 170.21 g/mol, XLogP of -0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxetan-3-ylamino)piperidin-2-one is sourced from PubChem (CID 63661229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).