3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine

C10H11F2NO — CID 103397020

IUPAC3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine
SMILESCOc1ccc(C2(F)CNC2)c(F)c1
InChIInChI=1S/C10H11F2NO/c1-14-7-2-3-8(9(11)4-7)10(12)5-13-6-10/h2-4,13H,5-6H2,1H3
InChIKeyRQBLULUWKFNYHT-UHFFFAOYSA-N
MW199.20 g/mol
LogP1.60
Rot. Bonds2

About 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine

3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine (PubChem CID 103397020) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine.

Molecular Properties

Compound Name3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine
PubChem CID103397020
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine
SMILESCOc1ccc(C2(F)CNC2)c(F)c1
InChIInChI=1S/C10H11F2NO/c1-14-7-2-3-8(9(11)4-7)10(12)5-13-6-10/h2-4,13H,5-6H2,1H3
InChIKeyRQBLULUWKFNYHT-UHFFFAOYSA-N
XLogP1.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluoro-4-methoxyphenyl)-2-methyl-1,3-dioxolane
CID 22615139
1-(2-fluoro-4-methoxyphenyl)cyclopropane-1-carboxamide
CID 141281979
[(3aS,6aR)-3a,6a-dimethyl-2,3,4,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-(2-fluoro-4-methoxyphenyl)methanone
CID 142469619
2-fluoro-1-(4-fluorophenyl)-4-methoxybenzene
CID 46312221
1-(2-fluoro-4-methoxyphenyl)-4-(methylamino)cyclohexan-1-ol
CID 103396883
1-(2-fluoro-4-methoxyphenyl)-4,4-dimethylcycloheptan-1-ol
CID 103395024
(3R)-3-fluoro-3-(3-methoxyphenyl)pyrrolidine
CID 124547155
1,1,2,2,3,3,4,4-octafluoro-6-methoxynaphthalene
CID 165383709
3-fluoro-6-methoxy-3-methyl-1,2-dihydroindene
CID 84718386
4-tert-butyl-1-(2-fluoro-4-methoxyphenyl)cyclohexan-1-amine
CID 103395169
2-(2-fluoro-4-methoxyphenyl)-2-propylazepane
CID 103395692
(5S,7R)-3-(2-fluoro-4-methoxyphenyl)adamantane-1-carboxylic acid
CID 2431648

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine?
The IUPAC name of 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine (CID 103397020) is 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine.
What is the SMILES notation for 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine?
The canonical SMILES for 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine is COc1ccc(C2(F)CNC2)c(F)c1.
What is the InChIKey of 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine?
The InChIKey is RQBLULUWKFNYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c1-14-7-2-3-8(9(11)4-7)10(12)5-13-6-10/h2-4,13H,5-6H2,1H3.
What are the key properties of 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine?
3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine has a molecular weight of 199.20 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(2-fluoro-4-methoxyphenyl)azetidine is sourced from PubChem (CID 103397020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).