2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone

C11H20N2O2 — CID 60645203

IUPAC2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone
SMILESO=C(CN1CCCC(O)C1)N1CCCC1
InChIInChI=1S/C11H20N2O2/c14-10-4-3-5-12(8-10)9-11(15)13-6-1-2-7-13/h10,14H,1-9H2
InChIKeySFUOJKZAOURENP-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.07
Rot. Bonds2

About 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone

2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone (PubChem CID 60645203) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone
PubChem CID60645203
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone
SMILESO=C(CN1CCCC(O)C1)N1CCCC1
InChIInChI=1S/C11H20N2O2/c14-10-4-3-5-12(8-10)9-11(15)13-6-1-2-7-13/h10,14H,1-9H2
InChIKeySFUOJKZAOURENP-UHFFFAOYSA-N
XLogP0.07
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(azocan-1-yl)-2-[(3S)-3-hydroxypiperidin-1-yl]ethanone
CID 107226024
1-(azepan-1-yl)-2-[(3R)-3-hydroxypiperidin-1-yl]ethanone
CID 129367078
1-(azocan-1-yl)-2-(3-hydroxypyrrolidin-1-yl)ethanone
CID 62917489
1-(azepan-1-yl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]ethanone
CID 78962281
2-(3-aminopiperidin-1-yl)-1-(azepan-1-yl)ethanone
CID 61296313
2-(3-acetylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 63844591
2-(4-aminopiperidin-1-yl)-1-[(3S)-3-hydroxypiperidin-1-yl]ethanone
CID 107222871
1-(azetidin-1-yl)-2-pyrrolidin-1-ylethanone
CID 91265703
2-(azetidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 130618835
1-[4-(2,3-dihydro-1H-inden-2-yl)-1,4-diazepan-1-yl]-2-[(3S)-3-hydroxypiperidin-1-yl]ethanone
CID 95862187
4-ethyl-1-[2-(3-hydroxypiperidin-1-yl)acetyl]piperidine-4-carboxylic acid;formic acid
CID 154904035
1-(azepan-1-yl)-2-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119918785

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone (CID 60645203) is 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone is O=C(CN1CCCC(O)C1)N1CCCC1.
What is the InChIKey of 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone?
The InChIKey is SFUOJKZAOURENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-10-4-3-5-12(8-10)9-11(15)13-6-1-2-7-13/h10,14H,1-9H2.
What are the key properties of 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone?
2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone has a molecular weight of 212.29 g/mol, XLogP of 0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypiperidin-1-yl)-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 60645203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).