1-(2-fluorophenyl)-3-methylazetidin-3-ol

C10H12FNO — CID 173302434

IUPAC1-(2-fluorophenyl)-3-methylazetidin-3-ol
SMILESCC1(O)CN(c2ccccc2F)C1
InChIInChI=1S/C10H12FNO/c1-10(13)6-12(7-10)9-5-3-2-4-8(9)11/h2-5,13H,6-7H2,1H3
InChIKeyNSDPJYHYKGLUBH-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.40
Rot. Bonds1

About 1-(2-fluorophenyl)-3-methylazetidin-3-ol

1-(2-fluorophenyl)-3-methylazetidin-3-ol (PubChem CID 173302434) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-methylazetidin-3-ol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-methylazetidin-3-ol
PubChem CID173302434
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name1-(2-fluorophenyl)-3-methylazetidin-3-ol
SMILESCC1(O)CN(c2ccccc2F)C1
InChIInChI=1S/C10H12FNO/c1-10(13)6-12(7-10)9-5-3-2-4-8(9)11/h2-5,13H,6-7H2,1H3
InChIKeyNSDPJYHYKGLUBH-UHFFFAOYSA-N
XLogP1.40
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-bis(2-fluorophenyl)-4,4-dimethylimidazolidine
CID 129229077
1-[[4-[1-(2-fluorophenyl)azetidin-3-yl]-2,6-dimethylphenyl]methyl]-3-methylazetidin-3-ol
CID 170736586
1-(3-amino-2-methylphenyl)-3-methylazetidin-3-ol
CID 130905487
1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol
CID 117025105
3-ethyl-1-(2-fluorophenyl)-3-methylpiperazine
CID 64924410
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CID 117024876
(1S)-1-[2-fluoro-6-(2,2,6,6-tetramethylmorpholin-4-yl)phenyl]ethanol
CID 102744613
4-(2-fluorophenyl)-6-(hydroxymethyl)-6-methylmorpholin-3-one
CID 115067563
1-[3-fluoro-2-[1-(methylamino)ethyl]phenyl]-4-methylpiperidin-4-ol
CID 81097018
2-[1-(2-fluorophenyl)-3-hydroxypiperidin-3-yl]acetic acid
CID 117002649
3-(difluoromethyl)-1-(2-fluorophenyl)pyrrolidin-3-amine
CID 115037625
2-fluoro-6-(2,2,6,6-tetramethylmorpholin-4-yl)aniline
CID 102742805

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-methylazetidin-3-ol?
The IUPAC name of 1-(2-fluorophenyl)-3-methylazetidin-3-ol (CID 173302434) is 1-(2-fluorophenyl)-3-methylazetidin-3-ol.
What is the SMILES notation for 1-(2-fluorophenyl)-3-methylazetidin-3-ol?
The canonical SMILES for 1-(2-fluorophenyl)-3-methylazetidin-3-ol is CC1(O)CN(c2ccccc2F)C1.
What is the InChIKey of 1-(2-fluorophenyl)-3-methylazetidin-3-ol?
The InChIKey is NSDPJYHYKGLUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-10(13)6-12(7-10)9-5-3-2-4-8(9)11/h2-5,13H,6-7H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-3-methylazetidin-3-ol?
1-(2-fluorophenyl)-3-methylazetidin-3-ol has a molecular weight of 181.21 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-methylazetidin-3-ol is sourced from PubChem (CID 173302434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).