azetidine;3-methoxypyrrolidine

C8H18N2O — CID 143553472

IUPACazetidine;3-methoxypyrrolidine
SMILESC1CNC1.COC1CCNC1
InChIInChI=1S/C5H11NO.C3H7N/c1-7-5-2-3-6-4-5;1-2-4-3-1/h5-6H,2-4H2,1H3;4H,1-3H2
InChIKeyLMVVRGTVKXUKQC-UHFFFAOYSA-N
MW158.25 g/mol
LogP-0.03
Rot. Bonds1

About azetidine;3-methoxypyrrolidine

azetidine;3-methoxypyrrolidine (PubChem CID 143553472) has the molecular formula C8H18N2O and a molecular weight of 158.25 g/mol. Its IUPAC name is azetidine;3-methoxypyrrolidine.

Molecular Properties

Compound Nameazetidine;3-methoxypyrrolidine
PubChem CID143553472
Molecular FormulaC8H18N2O
Molecular Weight158.25 g/mol
Exact Mass158.14
IUPAC Nameazetidine;3-methoxypyrrolidine
SMILESC1CNC1.COC1CCNC1
InChIInChI=1S/C5H11NO.C3H7N/c1-7-5-2-3-6-4-5;1-2-4-3-1/h5-6H,2-4H2,1H3;4H,1-3H2
InChIKeyLMVVRGTVKXUKQC-UHFFFAOYSA-N
XLogP-0.03
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.25
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of azetidine;3-methoxypyrrolidine?
The IUPAC name of azetidine;3-methoxypyrrolidine (CID 143553472) is azetidine;3-methoxypyrrolidine.
What is the SMILES notation for azetidine;3-methoxypyrrolidine?
The canonical SMILES for azetidine;3-methoxypyrrolidine is C1CNC1.COC1CCNC1.
What is the InChIKey of azetidine;3-methoxypyrrolidine?
The InChIKey is LMVVRGTVKXUKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C3H7N/c1-7-5-2-3-6-4-5;1-2-4-3-1/h5-6H,2-4H2,1H3;4H,1-3H2.
What are the key properties of azetidine;3-methoxypyrrolidine?
azetidine;3-methoxypyrrolidine has a molecular weight of 158.25 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azetidine;3-methoxypyrrolidine is sourced from PubChem (CID 143553472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).