1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol

C11H22N2O2 — CID 170985718

IUPAC1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol
SMILESCCN(CC)CC1(N2CC(O)C2)COC1
InChIInChI=1S/C11H22N2O2/c1-3-12(4-2)7-11(8-15-9-11)13-5-10(14)6-13/h10,14H,3-9H2,1-2H3
InChIKeyZTUKJEHLLWFPRX-UHFFFAOYSA-N
MW214.31 g/mol
LogP-0.23
Rot. Bonds5

About 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol

1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol (PubChem CID 170985718) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol.

Molecular Properties

Compound Name1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol
PubChem CID170985718
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol
SMILESCCN(CC)CC1(N2CC(O)C2)COC1
InChIInChI=1S/C11H22N2O2/c1-3-12(4-2)7-11(8-15-9-11)13-5-10(14)6-13/h10,14H,3-9H2,1-2H3
InChIKeyZTUKJEHLLWFPRX-UHFFFAOYSA-N
XLogP-0.23
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol?
The IUPAC name of 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol (CID 170985718) is 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol.
What is the SMILES notation for 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol?
The canonical SMILES for 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol is CCN(CC)CC1(N2CC(O)C2)COC1.
What is the InChIKey of 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol?
The InChIKey is ZTUKJEHLLWFPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-12(4-2)7-11(8-15-9-11)13-5-10(14)6-13/h10,14H,3-9H2,1-2H3.
What are the key properties of 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol?
1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol has a molecular weight of 214.31 g/mol, XLogP of -0.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(diethylaminomethyl)oxetan-3-yl]azetidin-3-ol is sourced from PubChem (CID 170985718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).