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

C11H20N2O — CID 137477244

IUPACazetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone
SMILESCCC1C(C)CCN1C(=O)N1CCC1
InChIInChI=1S/C11H20N2O/c1-3-10-9(2)5-8-13(10)11(14)12-6-4-7-12/h9-10H,3-8H2,1-2H3
InChIKeyPUQVAXHLUVANQV-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.93
Rot. Bonds1

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

azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone (PubChem CID 137477244) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Nameazetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone
PubChem CID137477244
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Nameazetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone
SMILESCCC1C(C)CCN1C(=O)N1CCC1
InChIInChI=1S/C11H20N2O/c1-3-10-9(2)5-8-13(10)11(14)12-6-4-7-12/h9-10H,3-8H2,1-2H3
InChIKeyPUQVAXHLUVANQV-UHFFFAOYSA-N
XLogP1.93
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone?
The IUPAC name of azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone (CID 137477244) is azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone is CCC1C(C)CCN1C(=O)N1CCC1.
What is the InChIKey of azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone?
The InChIKey is PUQVAXHLUVANQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-10-9(2)5-8-13(10)11(14)12-6-4-7-12/h9-10H,3-8H2,1-2H3.
What are the key properties of azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone?
azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone has a molecular weight of 196.29 g/mol, XLogP of 1.93, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl-(2-ethyl-3-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 137477244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).