1-(5-bromofuran-2-yl)azetidin-3-ol

C7H8BrNO2 — CID 172992364

IUPAC1-(5-bromofuran-2-yl)azetidin-3-ol
SMILESOC1CN(c2ccc(Br)o2)C1
InChIInChI=1S/C7H8BrNO2/c8-6-1-2-7(11-6)9-3-5(10)4-9/h1-2,5,10H,3-4H2
InChIKeyZUFSASYFWXNOIZ-UHFFFAOYSA-N
MW218.05 g/mol
LogP1.22
Rot. Bonds1

About 1-(5-bromofuran-2-yl)azetidin-3-ol

1-(5-bromofuran-2-yl)azetidin-3-ol (PubChem CID 172992364) has the molecular formula C7H8BrNO2 and a molecular weight of 218.05 g/mol. Its IUPAC name is 1-(5-bromofuran-2-yl)azetidin-3-ol.

Molecular Properties

Compound Name1-(5-bromofuran-2-yl)azetidin-3-ol
PubChem CID172992364
Molecular FormulaC7H8BrNO2
Molecular Weight218.05 g/mol
Exact Mass216.97
IUPAC Name1-(5-bromofuran-2-yl)azetidin-3-ol
SMILESOC1CN(c2ccc(Br)o2)C1
InChIInChI=1S/C7H8BrNO2/c8-6-1-2-7(11-6)9-3-5(10)4-9/h1-2,5,10H,3-4H2
InChIKeyZUFSASYFWXNOIZ-UHFFFAOYSA-N
XLogP1.22
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.05
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-bromofuran-2-yl)azetidin-3-ol?
The IUPAC name of 1-(5-bromofuran-2-yl)azetidin-3-ol (CID 172992364) is 1-(5-bromofuran-2-yl)azetidin-3-ol.
What is the SMILES notation for 1-(5-bromofuran-2-yl)azetidin-3-ol?
The canonical SMILES for 1-(5-bromofuran-2-yl)azetidin-3-ol is OC1CN(c2ccc(Br)o2)C1.
What is the InChIKey of 1-(5-bromofuran-2-yl)azetidin-3-ol?
The InChIKey is ZUFSASYFWXNOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO2/c8-6-1-2-7(11-6)9-3-5(10)4-9/h1-2,5,10H,3-4H2.
What are the key properties of 1-(5-bromofuran-2-yl)azetidin-3-ol?
1-(5-bromofuran-2-yl)azetidin-3-ol has a molecular weight of 218.05 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromofuran-2-yl)azetidin-3-ol is sourced from PubChem (CID 172992364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).