[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone

C11H19NO2 — CID 124675211

IUPAC[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
SMILESO=C([C@@H]1CCCNC1)[C@@H]1CCCOC1
InChIInChI=1S/C11H19NO2/c13-11(9-3-1-5-12-7-9)10-4-2-6-14-8-10/h9-10,12H,1-8H2/t9-,10-/m1/s1
InChIKeyLWDNPYURYLCSDU-NXEZZACHSA-N
MW197.28 g/mol
LogP0.98
Rot. Bonds2

About [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone

[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone (PubChem CID 124675211) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone.

Molecular Properties

Compound Name[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
PubChem CID124675211
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone
SMILESO=C([C@@H]1CCCNC1)[C@@H]1CCCOC1
InChIInChI=1S/C11H19NO2/c13-11(9-3-1-5-12-7-9)10-4-2-6-14-8-10/h9-10,12H,1-8H2/t9-,10-/m1/s1
InChIKeyLWDNPYURYLCSDU-NXEZZACHSA-N
XLogP0.98
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

di(piperidin-3-yl)methanone
CID 69183047
oxolan-3-yl(pyrrolidin-3-yl)methanone
CID 116568253
cyclobutyl-[(3R)-piperidin-3-yl]methanone
CID 124604189
(2-methylpiperidin-3-yl)-(oxan-3-yl)methanone
CID 130892569
(3R)-N-(oxan-3-ylmethyl)piperidine-3-carboxamide
CID 81128117
N-methyl-N-(oxan-3-ylmethyl)piperidine-3-carboxamide
CID 55227214
[(3S)-oxan-3-yl]-[(2R)-piperidin-2-yl]methanone
CID 124675210
cycloheptyl(oxolan-3-yl)methanone
CID 65399453
(3R)-oxane-3-carboxylic acid
CID 42554318
1,4-oxazepan-4-yl-[(3S)-piperidin-3-yl]methanone
CID 81141474
(3S)-N-(oxetan-3-yl)piperidine-3-carboxamide
CID 81134235
oxane-3-carboxamide
CID 22714381

Frequently Asked Questions

What is the IUPAC name of [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone?
The IUPAC name of [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone (CID 124675211) is [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone.
What is the SMILES notation for [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone?
The canonical SMILES for [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone is O=C([C@@H]1CCCNC1)[C@@H]1CCCOC1.
What is the InChIKey of [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone?
The InChIKey is LWDNPYURYLCSDU-NXEZZACHSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11(9-3-1-5-12-7-9)10-4-2-6-14-8-10/h9-10,12H,1-8H2/t9-,10-/m1/s1.
What are the key properties of [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone?
[(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone has a molecular weight of 197.28 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-oxan-3-yl]-[(3R)-piperidin-3-yl]methanone is sourced from PubChem (CID 124675211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).