2-fluoro-4-[(2R)-piperazin-2-yl]phenol

C10H13FN2O — CID 130910870

IUPAC2-fluoro-4-[(2R)-piperazin-2-yl]phenol
SMILESOc1ccc([C@@H]2CNCCN2)cc1F
InChIInChI=1S/C10H13FN2O/c11-8-5-7(1-2-10(8)14)9-6-12-3-4-13-9/h1-2,5,9,12-14H,3-4,6H2/t9-/m0/s1
InChIKeyBRIHZBMGKVGYQF-VIFPVBQESA-N
MW196.22 g/mol
LogP0.77
Rot. Bonds1

About 2-fluoro-4-[(2R)-piperazin-2-yl]phenol

2-fluoro-4-[(2R)-piperazin-2-yl]phenol (PubChem CID 130910870) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is 2-fluoro-4-[(2R)-piperazin-2-yl]phenol.

Molecular Properties

Compound Name2-fluoro-4-[(2R)-piperazin-2-yl]phenol
PubChem CID130910870
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC Name2-fluoro-4-[(2R)-piperazin-2-yl]phenol
SMILESOc1ccc([C@@H]2CNCCN2)cc1F
InChIInChI=1S/C10H13FN2O/c11-8-5-7(1-2-10(8)14)9-6-12-3-4-13-9/h1-2,5,9,12-14H,3-4,6H2/t9-/m0/s1
InChIKeyBRIHZBMGKVGYQF-VIFPVBQESA-N
XLogP0.77
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-4-[(2S)-piperazin-2-yl]phenol;hydrochloride
CID 171193540
2-bromo-4-[(2R)-piperazin-2-yl]phenol
CID 130705473
2-[3-fluoro-4-(trifluoromethyl)phenyl]piperazine
CID 91666755
2-fluoro-4-[(3R)-morpholin-3-yl]phenol
CID 96758561
(2R)-2-(4-fluoro-3-methylphenyl)piperazine;hydrochloride
CID 171194333
(2S)-2-[4-fluoro-3-(trifluoromethyl)phenyl]piperazine
CID 171193656
2-fluoro-4-piperidin-3-ylphenol
CID 82606236
2-fluoro-4-(5-methylpiperidin-2-yl)phenol
CID 164750952
ethane;methyl 2-hydroxy-4-piperazin-2-ylbenzoate
CID 171840246
2-(1,3-benzodioxol-5-yl)piperazine
CID 2771771
2,6-dichloro-4-[(2S)-piperazin-2-yl]phenol;hydrochloride
CID 171193729
3-piperazin-2-ylaniline
CID 45099675

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[(2R)-piperazin-2-yl]phenol?
The IUPAC name of 2-fluoro-4-[(2R)-piperazin-2-yl]phenol (CID 130910870) is 2-fluoro-4-[(2R)-piperazin-2-yl]phenol.
What is the SMILES notation for 2-fluoro-4-[(2R)-piperazin-2-yl]phenol?
The canonical SMILES for 2-fluoro-4-[(2R)-piperazin-2-yl]phenol is Oc1ccc([C@@H]2CNCCN2)cc1F.
What is the InChIKey of 2-fluoro-4-[(2R)-piperazin-2-yl]phenol?
The InChIKey is BRIHZBMGKVGYQF-VIFPVBQESA-N. The full InChI is InChI=1S/C10H13FN2O/c11-8-5-7(1-2-10(8)14)9-6-12-3-4-13-9/h1-2,5,9,12-14H,3-4,6H2/t9-/m0/s1.
What are the key properties of 2-fluoro-4-[(2R)-piperazin-2-yl]phenol?
2-fluoro-4-[(2R)-piperazin-2-yl]phenol has a molecular weight of 196.22 g/mol, XLogP of 0.77, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[(2R)-piperazin-2-yl]phenol is sourced from PubChem (CID 130910870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).