3-(2-chlorophenoxy)azetidine;hydrochloride

C9H11Cl2NO — CID 66591566

IUPAC3-(2-chlorophenoxy)azetidine;hydrochloride
SMILESCl.Clc1ccccc1OC1CNC1
InChIInChI=1S/C9H10ClNO.ClH/c10-8-3-1-2-4-9(8)12-7-5-11-6-7;/h1-4,7,11H,5-6H2;1H
InChIKeyOIJASKMSOZDCSI-UHFFFAOYSA-N
MW220.10 g/mol
LogP2.11
Rot. Bonds2

About 3-(2-chlorophenoxy)azetidine;hydrochloride

3-(2-chlorophenoxy)azetidine;hydrochloride (PubChem CID 66591566) has the molecular formula C9H11Cl2NO and a molecular weight of 220.10 g/mol. Its IUPAC name is 3-(2-chlorophenoxy)azetidine;hydrochloride.

Molecular Properties

Compound Name3-(2-chlorophenoxy)azetidine;hydrochloride
PubChem CID66591566
Molecular FormulaC9H11Cl2NO
Molecular Weight220.10 g/mol
Exact Mass219.02
IUPAC Name3-(2-chlorophenoxy)azetidine;hydrochloride
SMILESCl.Clc1ccccc1OC1CNC1
InChIInChI=1S/C9H10ClNO.ClH/c10-8-3-1-2-4-9(8)12-7-5-11-6-7;/h1-4,7,11H,5-6H2;1H
InChIKeyOIJASKMSOZDCSI-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 154894592
3-naphthalen-1-yloxyazetidine;hydrochloride
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carbonic acid;4-(2-chlorophenoxy)piperidine
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3-(2-chlorophenoxy)-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 103314300
3-[5-chloro-2-[2-(2-chlorophenyl)ethoxy]phenoxy]azetidine
CID 90792059
6-[(2-chlorophenoxy)methyl]-3-azabicyclo[3.1.0]hexane
CID 83823125
3-(2-methylsulfonylphenoxy)azetidine
CID 63105548
3-[[3-(2-chlorophenoxy)azetidin-1-yl]methyl]piperidine
CID 56898536
3-(1-benzothiophen-7-yloxy)azetidine
CID 84673442

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenoxy)azetidine;hydrochloride?
The IUPAC name of 3-(2-chlorophenoxy)azetidine;hydrochloride (CID 66591566) is 3-(2-chlorophenoxy)azetidine;hydrochloride.
What is the SMILES notation for 3-(2-chlorophenoxy)azetidine;hydrochloride?
The canonical SMILES for 3-(2-chlorophenoxy)azetidine;hydrochloride is Cl.Clc1ccccc1OC1CNC1.
What is the InChIKey of 3-(2-chlorophenoxy)azetidine;hydrochloride?
The InChIKey is OIJASKMSOZDCSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO.ClH/c10-8-3-1-2-4-9(8)12-7-5-11-6-7;/h1-4,7,11H,5-6H2;1H.
What are the key properties of 3-(2-chlorophenoxy)azetidine;hydrochloride?
3-(2-chlorophenoxy)azetidine;hydrochloride has a molecular weight of 220.10 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenoxy)azetidine;hydrochloride is sourced from PubChem (CID 66591566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).