3-(3-fluorocyclobutyl)azetidine;hydrochloride

C7H13ClFN — CID 155893833

IUPAC3-(3-fluorocyclobutyl)azetidine;hydrochloride
SMILESCl.FC1CC(C2CNC2)C1
InChIInChI=1S/C7H12FN.ClH/c8-7-1-5(2-7)6-3-9-4-6;/h5-7,9H,1-4H2;1H
InChIKeyDNRZYIDHFUXNGU-UHFFFAOYSA-N
MW165.64 g/mol
LogP1.38
Rot. Bonds1

About 3-(3-fluorocyclobutyl)azetidine;hydrochloride

3-(3-fluorocyclobutyl)azetidine;hydrochloride (PubChem CID 155893833) has the molecular formula C7H13ClFN and a molecular weight of 165.64 g/mol. Its IUPAC name is 3-(3-fluorocyclobutyl)azetidine;hydrochloride.

Molecular Properties

Compound Name3-(3-fluorocyclobutyl)azetidine;hydrochloride
PubChem CID155893833
Molecular FormulaC7H13ClFN
Molecular Weight165.64 g/mol
Exact Mass165.07
IUPAC Name3-(3-fluorocyclobutyl)azetidine;hydrochloride
SMILESCl.FC1CC(C2CNC2)C1
InChIInChI=1S/C7H12FN.ClH/c8-7-1-5(2-7)6-3-9-4-6;/h5-7,9H,1-4H2;1H
InChIKeyDNRZYIDHFUXNGU-UHFFFAOYSA-N
XLogP1.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.64
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorocyclobutyl)azetidine;hydrochloride?
The IUPAC name of 3-(3-fluorocyclobutyl)azetidine;hydrochloride (CID 155893833) is 3-(3-fluorocyclobutyl)azetidine;hydrochloride.
What is the SMILES notation for 3-(3-fluorocyclobutyl)azetidine;hydrochloride?
The canonical SMILES for 3-(3-fluorocyclobutyl)azetidine;hydrochloride is Cl.FC1CC(C2CNC2)C1.
What is the InChIKey of 3-(3-fluorocyclobutyl)azetidine;hydrochloride?
The InChIKey is DNRZYIDHFUXNGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN.ClH/c8-7-1-5(2-7)6-3-9-4-6;/h5-7,9H,1-4H2;1H.
What are the key properties of 3-(3-fluorocyclobutyl)azetidine;hydrochloride?
3-(3-fluorocyclobutyl)azetidine;hydrochloride has a molecular weight of 165.64 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorocyclobutyl)azetidine;hydrochloride is sourced from PubChem (CID 155893833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).