(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone

C10H17NO2 — CID 130634223

IUPAC(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone
SMILESCC1CN(C(=O)C2COC(C)C2)C1
InChIInChI=1S/C10H17NO2/c1-7-4-11(5-7)10(12)9-3-8(2)13-6-9/h7-9H,3-6H2,1-2H3
InChIKeyWMILFVVHCNWXEV-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.89
Rot. Bonds1

About (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone

(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone (PubChem CID 130634223) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone.

Molecular Properties

Compound Name(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone
PubChem CID130634223
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone
SMILESCC1CN(C(=O)C2COC(C)C2)C1
InChIInChI=1S/C10H17NO2/c1-7-4-11(5-7)10(12)9-3-8(2)13-6-9/h7-9H,3-6H2,1-2H3
InChIKeyWMILFVVHCNWXEV-UHFFFAOYSA-N
XLogP0.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone?
The IUPAC name of (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone (CID 130634223) is (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone.
What is the SMILES notation for (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone?
The canonical SMILES for (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone is CC1CN(C(=O)C2COC(C)C2)C1.
What is the InChIKey of (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone?
The InChIKey is WMILFVVHCNWXEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-7-4-11(5-7)10(12)9-3-8(2)13-6-9/h7-9H,3-6H2,1-2H3.
What are the key properties of (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone?
(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone has a molecular weight of 183.25 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone is sourced from PubChem (CID 130634223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).