[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone

C11H20N2O2 — CID 43133259

IUPAC[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone
SMILESO=C(C1CCCN1)N1CCC(CO)CC1
InChIInChI=1S/C11H20N2O2/c14-8-9-3-6-13(7-4-9)11(15)10-2-1-5-12-10/h9-10,12,14H,1-8H2
InChIKeyMHKQFPDPMJRADU-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.03
Rot. Bonds2

About [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone

[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone (PubChem CID 43133259) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone.

Molecular Properties

Compound Name[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone
PubChem CID43133259
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone
SMILESO=C(C1CCCN1)N1CCC(CO)CC1
InChIInChI=1S/C11H20N2O2/c14-8-9-3-6-13(7-4-9)11(15)10-2-1-5-12-10/h9-10,12,14H,1-8H2
InChIKeyMHKQFPDPMJRADU-UHFFFAOYSA-N
XLogP-0.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
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-(hydroxymethyl)pyrrolidin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 129393876
[4-(aminomethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone
CID 71084950
(4-aminopiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 131224010
(4-aminopiperidin-1-yl)-pyrrolidin-2-ylmethanone
CID 110461351
2-[1-(pyrrolidine-2-carbonyl)piperidin-4-yl]acetamide
CID 54873089
(4-propylpiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 94372824
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
[4-(methoxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone
CID 63978813
[4-(methoxymethyl)piperidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone;hydrochloride
CID 119319211
[(3R)-3-(fluoromethyl)pyrrolidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 129494191
[3-(hydroxymethyl)piperidin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 104912769
(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 154266528

Frequently Asked Questions

What is the IUPAC name of [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone?
The IUPAC name of [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone (CID 43133259) is [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone.
What is the SMILES notation for [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone?
The canonical SMILES for [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone is O=C(C1CCCN1)N1CCC(CO)CC1.
What is the InChIKey of [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone?
The InChIKey is MHKQFPDPMJRADU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-8-9-3-6-13(7-4-9)11(15)10-2-1-5-12-10/h9-10,12,14H,1-8H2.
What are the key properties of [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone?
[4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone has a molecular weight of 212.29 g/mol, XLogP of -0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(hydroxymethyl)piperidin-1-yl]-pyrrolidin-2-ylmethanone is sourced from PubChem (CID 43133259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).