(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone

C11H20N2O2 — CID 107219562

IUPAC(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
SMILESCCC1(O)CN(C(=O)C2CCNC2C)C1
InChIInChI=1S/C11H20N2O2/c1-3-11(15)6-13(7-11)10(14)9-4-5-12-8(9)2/h8-9,12,15H,3-7H2,1-2H3
InChIKeyNSXCIPXFNKNOCC-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.03
Rot. Bonds2

About (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone

(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone (PubChem CID 107219562) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone.

Molecular Properties

Compound Name(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
PubChem CID107219562
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
SMILESCCC1(O)CN(C(=O)C2CCNC2C)C1
InChIInChI=1S/C11H20N2O2/c1-3-11(15)6-13(7-11)10(14)9-4-5-12-8(9)2/h8-9,12,15H,3-7H2,1-2H3
InChIKeyNSXCIPXFNKNOCC-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

3-ethyl-1-(2-methylpyrrolidine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 79383810
4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
CID 79384911
(3-ethyl-3-hydroxyazetidin-1-yl)-[(2R)-pyrrolidin-2-yl]methanone
CID 107219512
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 81103357
N-ethyl-4-(2-methylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
CID 79389325
(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 102953558
(2-methylpyrrolidin-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 79388150
(3,5-dimethylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 79383471
(2-methylpyrrolidin-3-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 79388557
(3-ethyl-3-hydroxyazetidin-1-yl)-[(3R)-piperidin-3-yl]methanone
CID 107219702
[4-(methoxymethyl)piperidin-1-yl]-(2-methylpyrrolidin-3-yl)methanone
CID 79384209
(4-hydroxy-3-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 114678386

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone?
The IUPAC name of (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone (CID 107219562) is (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone.
What is the SMILES notation for (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone?
The canonical SMILES for (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone is CCC1(O)CN(C(=O)C2CCNC2C)C1.
What is the InChIKey of (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone?
The InChIKey is NSXCIPXFNKNOCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-11(15)6-13(7-11)10(14)9-4-5-12-8(9)2/h8-9,12,15H,3-7H2,1-2H3.
What are the key properties of (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone?
(3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone 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 (3-ethyl-3-hydroxyazetidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone is sourced from PubChem (CID 107219562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).