3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine

C16H14ClF2N — CID 79460895

IUPAC3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine
SMILESFc1ccc(CC2(c3ccccc3Cl)CNC2)c(F)c1
InChIInChI=1S/C16H14ClF2N/c17-14-4-2-1-3-13(14)16(9-20-10-16)8-11-5-6-12(18)7-15(11)19/h1-7,20H,8-10H2
InChIKeyFUGOQKUHJYJAOK-UHFFFAOYSA-N
MW293.74 g/mol
LogP3.70
Rot. Bonds3

About 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine

3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine (PubChem CID 79460895) has the molecular formula C16H14ClF2N and a molecular weight of 293.74 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine.

Molecular Properties

Compound Name3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine
PubChem CID79460895
Molecular FormulaC16H14ClF2N
Molecular Weight293.74 g/mol
Exact Mass293.08
IUPAC Name3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine
SMILESFc1ccc(CC2(c3ccccc3Cl)CNC2)c(F)c1
InChIInChI=1S/C16H14ClF2N/c17-14-4-2-1-3-13(14)16(9-20-10-16)8-11-5-6-12(18)7-15(11)19/h1-7,20H,8-10H2
InChIKeyFUGOQKUHJYJAOK-UHFFFAOYSA-N
XLogP3.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.74
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2-chloro-5-fluorophenyl)methyl]-3-(2-fluorophenyl)azetidine
CID 102621675
3-[(5-chloro-2-methoxyphenyl)methyl]-3-(2-chlorophenyl)azetidine
CID 79461001
3-(2-chlorophenyl)-3-[(3,4-dichlorophenyl)methyl]azetidine
CID 79459812
3-[(4-bromo-2-fluorophenyl)methyl]-3-(2-methylphenyl)azetidine
CID 79460160
3-chloro-4-[[3-(2-fluorophenyl)azetidin-3-yl]methyl]pyridine
CID 79459915
3-[(2,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)azetidine
CID 79460976
3-[(3,5-difluorophenyl)methyl]-3-(2-fluorophenyl)azetidine
CID 105411193
3-[(2-chloro-5-fluorophenyl)methyl]-3-(4-chlorophenyl)azetidine
CID 102621662
3-(2-fluorophenyl)-3-[(2-methylphenyl)methyl]azetidine
CID 79460505
3-[(2,4-difluorophenyl)methyl]-3-ethylazetidine
CID 79451763
3-(3-chlorophenyl)-3-[(2,5-difluorophenyl)methyl]azetidine
CID 79460198
3-[(2,4-difluorophenyl)methyl]-3-propylazetidine
CID 79451436

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine?
The IUPAC name of 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine (CID 79460895) is 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine.
What is the SMILES notation for 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine?
The canonical SMILES for 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine is Fc1ccc(CC2(c3ccccc3Cl)CNC2)c(F)c1.
What is the InChIKey of 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine?
The InChIKey is FUGOQKUHJYJAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClF2N/c17-14-4-2-1-3-13(14)16(9-20-10-16)8-11-5-6-12(18)7-15(11)19/h1-7,20H,8-10H2.
What are the key properties of 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine?
3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine has a molecular weight of 293.74 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-3-[(2,4-difluorophenyl)methyl]azetidine is sourced from PubChem (CID 79460895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).