[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol

C13H13FN2O2 — CID 116882683

IUPAC[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol
SMILESOCC1(c2ncc(-c3cccc(F)c3)[nH]2)COC1
InChIInChI=1S/C13H13FN2O2/c14-10-3-1-2-9(4-10)11-5-15-12(16-11)13(6-17)7-18-8-13/h1-5,17H,6-8H2,(H,15,16)
InChIKeyDCUKNSZSHDADSE-UHFFFAOYSA-N
MW248.26 g/mol
LogP1.48
Rot. Bonds3

About [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol

[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol (PubChem CID 116882683) has the molecular formula C13H13FN2O2 and a molecular weight of 248.26 g/mol. Its IUPAC name is [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol
PubChem CID116882683
Molecular FormulaC13H13FN2O2
Molecular Weight248.26 g/mol
Exact Mass248.10
IUPAC Name[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol
SMILESOCC1(c2ncc(-c3cccc(F)c3)[nH]2)COC1
InChIInChI=1S/C13H13FN2O2/c14-10-3-1-2-9(4-10)11-5-15-12(16-11)13(6-17)7-18-8-13/h1-5,17H,6-8H2,(H,15,16)
InChIKeyDCUKNSZSHDADSE-UHFFFAOYSA-N
XLogP1.48
TPSA58.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.26
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol 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

[3-(5-phenyl-1H-imidazol-2-yl)oxetan-3-yl]methanamine
CID 116882707
1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]cyclobutane-1-carboxylic acid
CID 116882402
[3-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol
CID 116882665
1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]cyclopropane-1-carbonitrile
CID 116881914
1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]cyclobutane-1-carbonitrile
CID 116882265
[3-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanamine
CID 116882710
2-amino-1-[5-(3-fluorophenyl)-1H-imidazol-2-yl]ethanol
CID 116881716
[1-(5-pyridin-4-yl-1H-imidazol-2-yl)cyclopropyl]methanol
CID 116882053
[5-(3-fluorophenyl)-1H-imidazol-2-yl]methanamine;hydrochloride
CID 157070146
[3-[5-(5-bromo-2-methoxyphenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol
CID 116882670
[3-(5-pyridin-4-yl-1H-imidazol-2-yl)oxetan-3-yl]methanamine
CID 116882740
[1-[5-(2,3-dihydro-1H-inden-5-yl)-1H-imidazol-2-yl]cyclopropyl]methanol
CID 116882014

Frequently Asked Questions

What is the IUPAC name of [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol?
The IUPAC name of [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol (CID 116882683) is [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol.
What is the SMILES notation for [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol?
The canonical SMILES for [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol is OCC1(c2ncc(-c3cccc(F)c3)[nH]2)COC1.
What is the InChIKey of [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol?
The InChIKey is DCUKNSZSHDADSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O2/c14-10-3-1-2-9(4-10)11-5-15-12(16-11)13(6-17)7-18-8-13/h1-5,17H,6-8H2,(H,15,16).
What are the key properties of [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol?
[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol has a molecular weight of 248.26 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]oxetan-3-yl]methanol is sourced from PubChem (CID 116882683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).