1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine

C9H18N2O — CID 64599135

IUPAC1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCN(C2CNC2)C1
InChIInChI=1S/C9H18N2O/c1-12-7-8-2-3-11(6-8)9-4-10-5-9/h8-10H,2-7H2,1H3
InChIKeyQHZIRQIJLVIORF-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.07
Rot. Bonds3

About 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine

1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine (PubChem CID 64599135) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine
PubChem CID64599135
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine
SMILESCOCC1CCN(C2CNC2)C1
InChIInChI=1S/C9H18N2O/c1-12-7-8-2-3-11(6-8)9-4-10-5-9/h8-10H,2-7H2,1H3
InChIKeyQHZIRQIJLVIORF-UHFFFAOYSA-N
XLogP-0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(azetidin-3-yl)-3-(3-methylbutyl)pyrrolidine
CID 122661427
(1S,5R)-3-(azetidin-3-yl)-6-(methoxymethyl)-3-azabicyclo[3.1.0]hexane
CID 130654042
1-cyclobutyl-4-(methoxymethyl)piperidine
CID 131107152
3-(methoxymethyl)-1-(6-methylpiperidin-3-yl)piperidine
CID 106587151
1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
CID 156885673
4-[4-(methoxymethyl)piperidin-1-yl]cyclohexan-1-amine
CID 63973090
N-ethyl-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexan-1-amine
CID 79618408
(1R,5S)-6-[4-(methoxymethyl)piperidin-1-yl]sulfonyl-3,6-diazabicyclo[3.2.2]nonane
CID 131943321
1-methanidyl-3-(methoxymethyl)pyrrolidine
CID 59130849
1-iodo-3-(methoxymethyl)pyrrolidine
CID 177173245
1-hydroxy-3-(methoxymethyl)pyrrolidine
CID 174152507
1-(azetidin-3-yl)pyrrolidin-3-ol
CID 55278856

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine?
The IUPAC name of 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine (CID 64599135) is 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine.
What is the SMILES notation for 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine?
The canonical SMILES for 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine is COCC1CCN(C2CNC2)C1.
What is the InChIKey of 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine?
The InChIKey is QHZIRQIJLVIORF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-12-7-8-2-3-11(6-8)9-4-10-5-9/h8-10H,2-7H2,1H3.
What are the key properties of 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine?
1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine has a molecular weight of 170.26 g/mol, XLogP of -0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-3-(methoxymethyl)pyrrolidine is sourced from PubChem (CID 64599135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).