2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine

C13H18ClN — CID 115058529

IUPAC2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine
SMILESCC(C)CC1(c2ccccc2Cl)CCN1
InChIInChI=1S/C13H18ClN/c1-10(2)9-13(7-8-15-13)11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3
InChIKeyUZBUEJNUBRSFEW-UHFFFAOYSA-N
MW223.75 g/mol
LogP3.57
Rot. Bonds3

About 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine

2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine (PubChem CID 115058529) has the molecular formula C13H18ClN and a molecular weight of 223.75 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine
PubChem CID115058529
Molecular FormulaC13H18ClN
Molecular Weight223.75 g/mol
Exact Mass223.11
IUPAC Name2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine
SMILESCC(C)CC1(c2ccccc2Cl)CCN1
InChIInChI=1S/C13H18ClN/c1-10(2)9-13(7-8-15-13)11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3
InChIKeyUZBUEJNUBRSFEW-UHFFFAOYSA-N
XLogP3.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.75
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(2-chlorophenyl)azetidin-2-yl]methanamine
CID 115059255
2-(2-chlorophenyl)-4,4-difluoro-2-methylpiperidine
CID 115045643
2-(2-chlorophenyl)-2-(methoxymethyl)pyrrolidine
CID 117271928
4-(2-chlorophenyl)-4-propan-2-ylpiperidine
CID 83897892
1-chloro-2-[1-(1-fluoroethyl)cyclopropyl]benzene
CID 84721034
N-[[1-(2-chlorophenyl)cyclobutyl]methyl]-2-methylpropan-1-amine
CID 55091372
N-[[1-(2-chlorophenyl)cyclopropyl]methyl]propan-2-amine
CID 62596205
2-(2-methoxyphenyl)-2-propylazetidine
CID 115058535
4-(2-chlorophenyl)-4-(difluoromethyl)piperidine
CID 84737369
2-[2-(2-chlorophenyl)ethyl]-2-propan-2-ylpyrrolidine
CID 117271523
tert-butyl N-[[2-(2-chlorophenyl)pyrrolidin-2-yl]methyl]carbamate
CID 115059198
1-chloro-2-[1-(2-chlorophenyl)cyclopentyl]benzene
CID 142095779

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine?
The IUPAC name of 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine (CID 115058529) is 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine.
What is the SMILES notation for 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine?
The canonical SMILES for 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine is CC(C)CC1(c2ccccc2Cl)CCN1.
What is the InChIKey of 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine?
The InChIKey is UZBUEJNUBRSFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN/c1-10(2)9-13(7-8-15-13)11-5-3-4-6-12(11)14/h3-6,10,15H,7-9H2,1-2H3.
What are the key properties of 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine?
2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine has a molecular weight of 223.75 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-(2-methylpropyl)azetidine is sourced from PubChem (CID 115058529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).