[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone

C11H20N2O2 — CID 121201480

IUPAC[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone
SMILESCOCC1CCCN1C(=O)C1CCCN1
InChIInChI=1S/C11H20N2O2/c1-15-8-9-4-3-7-13(9)11(14)10-5-2-6-12-10/h9-10,12H,2-8H2,1H3
InChIKeyAHHSHAHXZGTRML-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.38
Rot. Bonds3

About [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone

[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone (PubChem CID 121201480) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone.

Molecular Properties

Compound Name[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone
PubChem CID121201480
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone
SMILESCOCC1CCCN1C(=O)C1CCCN1
InChIInChI=1S/C11H20N2O2/c1-15-8-9-4-3-7-13(9)11(14)10-5-2-6-12-10/h9-10,12H,2-8H2,1H3
InChIKeyAHHSHAHXZGTRML-UHFFFAOYSA-N
XLogP0.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-2-(methoxymethyl)piperidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 129359602
[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone
CID 103840926
(2-ethylpiperidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 103793731
(2-ethylpiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 61154160
(2-ethylpiperidin-1-yl)-pyrrolidin-2-ylmethanone;hydrochloride
CID 56831896
[2-(hydroxymethyl)pyrrolidin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 104913741
[2-(3-hydroxypropyl)pyrrolidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 62479213
(2-propylpiperidin-1-yl)-[(2S)-pyrrolidin-2-yl]methanone
CID 83052563
azepan-2-yl-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 107217930
(2-ethylpiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 104912723
cyclohexyl-[2-(methoxymethyl)pyrrolidin-1-yl]methanone
CID 110869949
[2-(2-hydroxyethyl)piperidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone
CID 61149225

Frequently Asked Questions

What is the IUPAC name of [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone?
The IUPAC name of [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone (CID 121201480) is [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone.
What is the SMILES notation for [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone?
The canonical SMILES for [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone is COCC1CCCN1C(=O)C1CCCN1.
What is the InChIKey of [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone?
The InChIKey is AHHSHAHXZGTRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-15-8-9-4-3-7-13(9)11(14)10-5-2-6-12-10/h9-10,12H,2-8H2,1H3.
What are the key properties of [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone?
[2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone has a molecular weight of 212.29 g/mol, XLogP of 0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethyl)pyrrolidin-1-yl]-pyrrolidin-2-ylmethanone is sourced from PubChem (CID 121201480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).