2-(2-chlorophenyl)-1-methylazetidine

C10H12ClN — CID 122207615

IUPAC2-(2-chlorophenyl)-1-methylazetidine
SMILESCN1CCC1c1ccccc1Cl
InChIInChI=1S/C10H12ClN/c1-12-7-6-10(12)8-4-2-3-5-9(8)11/h2-5,10H,6-7H2,1H3
InChIKeyKEZJDPGUFICIJN-UHFFFAOYSA-N
MW181.67 g/mol
LogP2.72
Rot. Bonds1

About 2-(2-chlorophenyl)-1-methylazetidine

2-(2-chlorophenyl)-1-methylazetidine (PubChem CID 122207615) has the molecular formula C10H12ClN and a molecular weight of 181.67 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-methylazetidine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-methylazetidine
PubChem CID122207615
Molecular FormulaC10H12ClN
Molecular Weight181.67 g/mol
Exact Mass181.07
IUPAC Name2-(2-chlorophenyl)-1-methylazetidine
SMILESCN1CCC1c1ccccc1Cl
InChIInChI=1S/C10H12ClN/c1-12-7-6-10(12)8-4-2-3-5-9(8)11/h2-5,10H,6-7H2,1H3
InChIKeyKEZJDPGUFICIJN-UHFFFAOYSA-N
XLogP2.72
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.67
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-chlorophenyl)methyl]-1-phenylpropan-2-amine
CID 71675
Clobenzorex
CID 735998
Benzenemethanamine, 2-chloro-N-methyl-
CID 66754
[2-Amino-1-(2-Chlorophenyl)Ethyl]Dimethylamine
CID 3158580
1-(2-Chlorophenyl)ethanamine
CID 299767
2-(2-Chlorophenyl)-N,N-dimethylethanamine
CID 176468
Pyrrolidine, 2-(4-chlorophenyl)-1-methyl-
CID 44387149
Benzenemethanamine, N-butyl-2-chloro-
CID 485398
(4-Chlorophenyl)(dimethylamino)acetonitrile
CID 27129
[1-(4-Chlorophenyl)ethyl](methyl)amine
CID 4984087
(1-(2-Chlorophenyl)ethyl)(methyl)amine
CID 16783514
(1-(3-Chlorophenyl)ethyl)(methyl)amine
CID 16790685

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-methylazetidine?
The IUPAC name of 2-(2-chlorophenyl)-1-methylazetidine (CID 122207615) is 2-(2-chlorophenyl)-1-methylazetidine.
What is the SMILES notation for 2-(2-chlorophenyl)-1-methylazetidine?
The canonical SMILES for 2-(2-chlorophenyl)-1-methylazetidine is CN1CCC1c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-1-methylazetidine?
The InChIKey is KEZJDPGUFICIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN/c1-12-7-6-10(12)8-4-2-3-5-9(8)11/h2-5,10H,6-7H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-1-methylazetidine?
2-(2-chlorophenyl)-1-methylazetidine has a molecular weight of 181.67 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-methylazetidine is sourced from PubChem (CID 122207615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).