(2R)-2-(3-fluoro-4-methylphenyl)azetidine

C10H12FN — CID 130737796

IUPAC(2R)-2-(3-fluoro-4-methylphenyl)azetidine
SMILESCc1ccc([C@H]2CCN2)cc1F
InChIInChI=1S/C10H12FN/c1-7-2-3-8(6-9(7)11)10-4-5-12-10/h2-3,6,10,12H,4-5H2,1H3/t10-/m1/s1
InChIKeyMLGVHDVFJSCPRT-SNVBAGLBSA-N
MW165.21 g/mol
LogP2.17
Rot. Bonds1

About (2R)-2-(3-fluoro-4-methylphenyl)azetidine

(2R)-2-(3-fluoro-4-methylphenyl)azetidine (PubChem CID 130737796) has the molecular formula C10H12FN and a molecular weight of 165.21 g/mol. Its IUPAC name is (2R)-2-(3-fluoro-4-methylphenyl)azetidine.

Molecular Properties

Compound Name(2R)-2-(3-fluoro-4-methylphenyl)azetidine
PubChem CID130737796
Molecular FormulaC10H12FN
Molecular Weight165.21 g/mol
Exact Mass165.10
IUPAC Name(2R)-2-(3-fluoro-4-methylphenyl)azetidine
SMILESCc1ccc([C@H]2CCN2)cc1F
InChIInChI=1S/C10H12FN/c1-7-2-3-8(6-9(7)11)10-4-5-12-10/h2-3,6,10,12H,4-5H2,1H3/t10-/m1/s1
InChIKeyMLGVHDVFJSCPRT-SNVBAGLBSA-N
XLogP2.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2R)-2-(3-fluoro-4-methylphenyl)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

2-(3-fluoro-4-methylphenyl)-4-methylpiperidine
CID 115502554
2-(3-fluoro-4-methylphenyl)-3-methylpyrrolidine
CID 64687702
(2R)-2-(3-chloro-4-methylphenyl)azetidine;hydrochloride
CID 171197250
4-cyclopropyl-2-fluoro-1-methylbenzene;ethane
CID 177038852
(2R)-2-[3-fluoro-4-(trifluoromethyl)phenyl]azetidine;hydrochloride
CID 171197362
(4R)-4-(3-fluoro-4-methylphenyl)-1,3-oxazinan-2-one
CID 171185070
(4S)-4-(3-fluoro-4-methylphenyl)-1,3-oxazolidin-2-one;hydrochloride
CID 171183858
5-[(2S)-azetidin-2-yl]-2-methylbenzoic acid
CID 131057016
4-(azetidin-2-yl)-2-methylbenzonitrile
CID 55282910
(2R)-2-(4-methoxy-3-methylphenyl)azetidine
CID 130665442
2-(4-fluorophenyl)azetidine;hydrochloride
CID 155891542
[5-(azetidin-2-yl)-2-fluorophenyl]methanol
CID 55283312

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-fluoro-4-methylphenyl)azetidine?
The IUPAC name of (2R)-2-(3-fluoro-4-methylphenyl)azetidine (CID 130737796) is (2R)-2-(3-fluoro-4-methylphenyl)azetidine.
What is the SMILES notation for (2R)-2-(3-fluoro-4-methylphenyl)azetidine?
The canonical SMILES for (2R)-2-(3-fluoro-4-methylphenyl)azetidine is Cc1ccc([C@H]2CCN2)cc1F.
What is the InChIKey of (2R)-2-(3-fluoro-4-methylphenyl)azetidine?
The InChIKey is MLGVHDVFJSCPRT-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12FN/c1-7-2-3-8(6-9(7)11)10-4-5-12-10/h2-3,6,10,12H,4-5H2,1H3/t10-/m1/s1.
What are the key properties of (2R)-2-(3-fluoro-4-methylphenyl)azetidine?
(2R)-2-(3-fluoro-4-methylphenyl)azetidine has a molecular weight of 165.21 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-fluoro-4-methylphenyl)azetidine is sourced from PubChem (CID 130737796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).