3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine

C14H14FNO — CID 83183543

IUPAC3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine
SMILESFc1ccc(C2(Cc3ccoc3)CNC2)cc1
InChIInChI=1S/C14H14FNO/c15-13-3-1-12(2-4-13)14(9-16-10-14)7-11-5-6-17-8-11/h1-6,8,16H,7,9-10H2
InChIKeyILSPEAAEAYDEGJ-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.50
Rot. Bonds3

About 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine

3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine (PubChem CID 83183543) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine
PubChem CID83183543
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine
SMILESFc1ccc(C2(Cc3ccoc3)CNC2)cc1
InChIInChI=1S/C14H14FNO/c15-13-3-1-12(2-4-13)14(9-16-10-14)7-11-5-6-17-8-11/h1-6,8,16H,7,9-10H2
InChIKeyILSPEAAEAYDEGJ-UHFFFAOYSA-N
XLogP2.50
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-chlorophenyl)-3-[(4-fluorophenyl)methyl]azetidine
CID 79451271
3-(4-fluorophenyl)-3-[(4-iodophenyl)methyl]azetidine
CID 79460170
3-[(5-ethylthiophen-2-yl)methyl]-3-(4-fluorophenyl)azetidine
CID 79460562
3-[(4-fluoro-2-methylphenyl)methyl]-3-(4-fluorophenyl)azetidine
CID 114350031
5-[2-[3-(4-fluorophenyl)azetidin-3-yl]ethyl]-1-methylpyrazole
CID 103019187
3-(3-bromophenyl)-3-[(4-fluorophenyl)methyl]azetidine
CID 79461032
3-[(2,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)azetidine
CID 79460976
1,3-diethyl-5-[[3-(4-fluorophenyl)azetidin-3-yl]methyl]pyrazole
CID 79460063
3-[(2-chloro-5-fluorophenyl)methyl]-3-(4-chlorophenyl)azetidine
CID 102621662
3-[(2-bromo-4-fluorophenyl)methyl]-3-(4-bromophenyl)azetidine
CID 79460518
3-benzyl-3-(4-methylphenyl)azetidine
CID 79452492
3-(4-chlorophenyl)-3-[(5-fluoro-2-methylphenyl)methyl]azetidine
CID 105376161

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine?
The IUPAC name of 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine (CID 83183543) is 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine.
What is the SMILES notation for 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine?
The canonical SMILES for 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine is Fc1ccc(C2(Cc3ccoc3)CNC2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine?
The InChIKey is ILSPEAAEAYDEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c15-13-3-1-12(2-4-13)14(9-16-10-14)7-11-5-6-17-8-11/h1-6,8,16H,7,9-10H2.
What are the key properties of 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine?
3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine has a molecular weight of 231.27 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-3-(furan-3-ylmethyl)azetidine is sourced from PubChem (CID 83183543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).