2-(2-fluoro-6-methoxyphenyl)azetidine

C10H12FNO — CID 55282434

IUPAC2-(2-fluoro-6-methoxyphenyl)azetidine
SMILESCOc1cccc(F)c1C1CCN1
InChIInChI=1S/C10H12FNO/c1-13-9-4-2-3-7(11)10(9)8-5-6-12-8/h2-4,8,12H,5-6H2,1H3
InChIKeyORYXZQOMJOXIJR-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.87
Rot. Bonds2

About 2-(2-fluoro-6-methoxyphenyl)azetidine

2-(2-fluoro-6-methoxyphenyl)azetidine (PubChem CID 55282434) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 2-(2-fluoro-6-methoxyphenyl)azetidine.

Molecular Properties

Compound Name2-(2-fluoro-6-methoxyphenyl)azetidine
PubChem CID55282434
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name2-(2-fluoro-6-methoxyphenyl)azetidine
SMILESCOc1cccc(F)c1C1CCN1
InChIInChI=1S/C10H12FNO/c1-13-9-4-2-3-7(11)10(9)8-5-6-12-8/h2-4,8,12H,5-6H2,1H3
InChIKeyORYXZQOMJOXIJR-UHFFFAOYSA-N
XLogP1.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-fluoro-3-methoxybenzene
CID 144811064
3-(2-fluoro-6-methoxyphenyl)pyrrolidine;hydrochloride
CID 169498266
5-(2-fluoro-6-methoxyphenyl)-2-methyl-1,4-thiazinane 1,1-dioxide
CID 113389375
(2R)-2-(2-bromo-6-fluorophenyl)azetidine;hydrochloride
CID 171197230
(2R)-2-(2-methoxyphenyl)azetidine
CID 92670019
2-(2,6-dimethoxyphenyl)-3-methylpyrrolidine
CID 3362544
(2R)-2-(2,3-dimethoxyphenyl)azetidine;hydrochloride
CID 171197120
(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine
CID 165345527
(2S)-2-(2,6-difluoro-3-methoxyphenyl)pyrrolidine;hydrochloride
CID 171196574
2-(azetidin-2-yl)-3-fluorobenzoic acid
CID 55297953
(2R)-2-(2,4,6-trimethoxyphenyl)azetidine
CID 171197166
[(1R)-2-(2-fluoro-6-methoxyphenyl)cyclopropyl]methanol
CID 130347052

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-6-methoxyphenyl)azetidine?
The IUPAC name of 2-(2-fluoro-6-methoxyphenyl)azetidine (CID 55282434) is 2-(2-fluoro-6-methoxyphenyl)azetidine.
What is the SMILES notation for 2-(2-fluoro-6-methoxyphenyl)azetidine?
The canonical SMILES for 2-(2-fluoro-6-methoxyphenyl)azetidine is COc1cccc(F)c1C1CCN1.
What is the InChIKey of 2-(2-fluoro-6-methoxyphenyl)azetidine?
The InChIKey is ORYXZQOMJOXIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-13-9-4-2-3-7(11)10(9)8-5-6-12-8/h2-4,8,12H,5-6H2,1H3.
What are the key properties of 2-(2-fluoro-6-methoxyphenyl)azetidine?
2-(2-fluoro-6-methoxyphenyl)azetidine has a molecular weight of 181.21 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-6-methoxyphenyl)azetidine is sourced from PubChem (CID 55282434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).