[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone

C14H24N2O2 — CID 141196661

IUPAC[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone
SMILESO=C([C@@H]1CCCO1)N1CC[C@H](N2CCCCC2)C1
InChIInChI=1S/C14H24N2O2/c17-14(13-5-4-10-18-13)16-9-6-12(11-16)15-7-2-1-3-8-15/h12-13H,1-11H2/t12-,13-/m0/s1
InChIKeyUSGYQELJXORBFS-STQMWFEESA-N
MW252.36 g/mol
LogP1.25
Rot. Bonds2

About [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone

[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone (PubChem CID 141196661) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone
PubChem CID141196661
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone
SMILESO=C([C@@H]1CCCO1)N1CC[C@H](N2CCCCC2)C1
InChIInChI=1S/C14H24N2O2/c17-14(13-5-4-10-18-13)16-9-6-12(11-16)15-7-2-1-3-8-15/h12-13H,1-11H2/t12-,13-/m0/s1
InChIKeyUSGYQELJXORBFS-STQMWFEESA-N
XLogP1.25
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone?
The IUPAC name of [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone (CID 141196661) is [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone.
What is the SMILES notation for [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone?
The canonical SMILES for [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone is O=C([C@@H]1CCCO1)N1CC[C@H](N2CCCCC2)C1.
What is the InChIKey of [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone?
The InChIKey is USGYQELJXORBFS-STQMWFEESA-N. The full InChI is InChI=1S/C14H24N2O2/c17-14(13-5-4-10-18-13)16-9-6-12(11-16)15-7-2-1-3-8-15/h12-13H,1-11H2/t12-,13-/m0/s1.
What are the key properties of [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone?
[(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone has a molecular weight of 252.36 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-oxolan-2-yl]-[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methanone is sourced from PubChem (CID 141196661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).