[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol

C12H15FINO — CID 155172642

IUPAC[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2ccc(I)cc2F)CC1
InChIInChI=1S/C12H15FINO/c13-11-7-10(14)1-2-12(11)15-5-3-9(8-16)4-6-15/h1-2,7,9,16H,3-6,8H2
InChIKeyCWLWEGFOEXASQB-UHFFFAOYSA-N
MW335.16 g/mol
LogP2.64
Rot. Bonds2

About [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol

[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol (PubChem CID 155172642) has the molecular formula C12H15FINO and a molecular weight of 335.16 g/mol. Its IUPAC name is [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol
PubChem CID155172642
Molecular FormulaC12H15FINO
Molecular Weight335.16 g/mol
Exact Mass335.02
IUPAC Name[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol
SMILESOCC1CCN(c2ccc(I)cc2F)CC1
InChIInChI=1S/C12H15FINO/c13-11-7-10(14)1-2-12(11)15-5-3-9(8-16)4-6-15/h1-2,7,9,16H,3-6,8H2
InChIKeyCWLWEGFOEXASQB-UHFFFAOYSA-N
XLogP2.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.16
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

[1-[2-fluoro-4-(hydroxymethyl)phenyl]piperidin-4-yl]methanol
CID 43133225
[1-(4-amino-2-fluorophenyl)piperidin-4-yl]methanol
CID 43133145
[1-[4-[(1S)-1-aminoethyl]-2-fluorophenyl]piperidin-4-yl]methanol
CID 78936152
3-fluoro-4-[4-(hydroxymethyl)piperidin-1-yl]benzenecarboximidamide;hydrochloride
CID 82253493
[1-[2-fluoro-4-(hydroxymethyl)phenyl]pyrrolidin-3-yl]methanol
CID 112626287
[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol
CID 60790060
1-(2-fluoro-4-iodophenyl)pyrrolidine-3-carbaldehyde
CID 164851294
[1-[2-fluoro-4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]piperidin-4-yl]methanol
CID 82250935
[1-(2,4,5-trifluorophenyl)pyrrolidin-3-yl]methanol
CID 64868848
5-fluoro-2-[4-(hydroxymethyl)piperidin-1-yl]benzenecarbothioamide
CID 63673694
3-fluoro-4-[3-(hydroxymethyl)pyrrolidin-1-yl]benzenecarboximidamide
CID 112625734
[1-(4-amino-2-fluoro-5-methoxyphenyl)piperidin-4-yl]methanol
CID 107258751

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol?
The IUPAC name of [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol (CID 155172642) is [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol is OCC1CCN(c2ccc(I)cc2F)CC1.
What is the InChIKey of [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol?
The InChIKey is CWLWEGFOEXASQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FINO/c13-11-7-10(14)1-2-12(11)15-5-3-9(8-16)4-6-15/h1-2,7,9,16H,3-6,8H2.
What are the key properties of [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol?
[1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol has a molecular weight of 335.16 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-4-iodophenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 155172642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).