[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone

C11H20N2O2 — CID 93086400

IUPAC[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone
SMILESO=C([C@H]1CCCNC1)N1CCC[C@H](O)C1
InChIInChI=1S/C11H20N2O2/c14-10-4-2-6-13(8-10)11(15)9-3-1-5-12-7-9/h9-10,12,14H,1-8H2/t9-,10-/m0/s1
InChIKeyTUHUSZCYDRBZDM-UWVGGRQHSA-N
MW212.29 g/mol
LogP-0.03
Rot. Bonds1

About [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone

[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone (PubChem CID 93086400) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone.

Molecular Properties

Compound Name[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone
PubChem CID93086400
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone
SMILESO=C([C@H]1CCCNC1)N1CCC[C@H](O)C1
InChIInChI=1S/C11H20N2O2/c14-10-4-2-6-13(8-10)11(15)9-3-1-5-12-7-9/h9-10,12,14H,1-8H2/t9-,10-/m0/s1
InChIKeyTUHUSZCYDRBZDM-UWVGGRQHSA-N
XLogP-0.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-3-hydroxypiperidin-1-yl]-pyrrolidin-3-ylmethanone
CID 107222844
azepan-1-yl-[(3S)-piperidin-3-yl]methanone
CID 7169846
azocan-1-yl(piperidin-3-yl)methanone
CID 43211901
cyclopentyl-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 93040537
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-[(3R)-piperidin-3-yl]methanone
CID 81141639
cyclopropyl-[3-(3-hydroxypiperidine-1-carbonyl)piperidin-1-yl]methanone
CID 43502686
(3R)-1-(pyrrolidine-3-carbonyl)piperidine-3-carboxylic acid
CID 81120944
3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl(piperidin-3-yl)methanone
CID 43620377
piperidin-3-yl-(3-propylpiperidin-1-yl)methanone;hydrochloride
CID 119337253
4-(piperidine-3-carbonyl)-1,4-diazepane-1-carboxylic acid
CID 67493567
(2-methyl-1,4-oxazepan-4-yl)-[(3S)-piperidin-3-yl]methanone
CID 81141316
acetaldehyde;methane;[(3S)-piperidin-3-yl]-pyrrolidin-1-ylmethanone;hydroiodide
CID 142545183

Frequently Asked Questions

What is the IUPAC name of [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone?
The IUPAC name of [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone (CID 93086400) is [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone.
What is the SMILES notation for [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone?
The canonical SMILES for [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone is O=C([C@H]1CCCNC1)N1CCC[C@H](O)C1.
What is the InChIKey of [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone?
The InChIKey is TUHUSZCYDRBZDM-UWVGGRQHSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-10-4-2-6-13(8-10)11(15)9-3-1-5-12-7-9/h9-10,12,14H,1-8H2/t9-,10-/m0/s1.
What are the key properties of [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone?
[(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone has a molecular weight of 212.29 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-hydroxypiperidin-1-yl]-[(3S)-piperidin-3-yl]methanone is sourced from PubChem (CID 93086400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).