1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol

C14H20FNO2 — CID 156722310

IUPAC1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol
SMILESCC(O)COc1ccc(F)cc1C1CCNCC1
InChIInChI=1S/C14H20FNO2/c1-10(17)9-18-14-3-2-12(15)8-13(14)11-4-6-16-7-5-11/h2-3,8,10-11,16-17H,4-7,9H2,1H3
InChIKeyZNNYZUVARRBVIW-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.05
Rot. Bonds4

About 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol

1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol (PubChem CID 156722310) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol.

Molecular Properties

Compound Name1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol
PubChem CID156722310
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol
SMILESCC(O)COc1ccc(F)cc1C1CCNCC1
InChIInChI=1S/C14H20FNO2/c1-10(17)9-18-14-3-2-12(15)8-13(14)11-4-6-16-7-5-11/h2-3,8,10-11,16-17H,4-7,9H2,1H3
InChIKeyZNNYZUVARRBVIW-UHFFFAOYSA-N
XLogP2.05
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(5-fluoro-2-propan-2-ylphenyl)piperidine
CID 84788145
1-(2-chloro-4-fluorophenoxy)propan-2-ol
CID 65277724
N-[1-(2,4-difluorophenoxy)propan-2-yl]piperidine-4-carboxamide;hydrochloride
CID 119299969
4-(2-bromo-5-fluorophenyl)piperidine
CID 84709377
3-[(2-cyclopentyl-4-fluorophenoxy)methyl]-3-methylpyrrolidine
CID 130297112
4-[5-fluoro-2-(2-methoxyphenyl)sulfanylphenyl]piperidine
CID 11415864
1-[2-[(1R)-1-aminoethyl]-5-fluorophenoxy]propan-2-ol
CID 63368001
N-cyclopropyl-4-fluoro-2-(2-hydroxypropoxy)benzamide
CID 174428773
1-(4-fluoro-2-nitrophenoxy)propan-2-ol
CID 65277245
2-[2-piperidin-4-yl-4-(trifluoromethyl)phenoxy]-N-propan-2-ylacetamide;hydrochloride
CID 166174067
5-fluoro-2-piperidin-4-ylaniline
CID 117103758
2-cyclopentyl-4-fluoro-1-methoxybenzene
CID 67457026

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol?
The IUPAC name of 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol (CID 156722310) is 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol.
What is the SMILES notation for 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol?
The canonical SMILES for 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol is CC(O)COc1ccc(F)cc1C1CCNCC1.
What is the InChIKey of 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol?
The InChIKey is ZNNYZUVARRBVIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-10(17)9-18-14-3-2-12(15)8-13(14)11-4-6-16-7-5-11/h2-3,8,10-11,16-17H,4-7,9H2,1H3.
What are the key properties of 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol?
1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol has a molecular weight of 253.32 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-piperidin-4-ylphenoxy)propan-2-ol is sourced from PubChem (CID 156722310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).