1-[(2,5-difluorophenyl)methyl]piperidin-4-ol

C12H15F2NO — CID 24904993

IUPAC1-[(2,5-difluorophenyl)methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cc(F)ccc2F)CC1
InChIInChI=1S/C12H15F2NO/c13-10-1-2-12(14)9(7-10)8-15-5-3-11(16)4-6-15/h1-2,7,11,16H,3-6,8H2
InChIKeyKGADSJUJEGZYHI-UHFFFAOYSA-N
MW227.25 g/mol
LogP1.92
Rot. Bonds2

About 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol

1-[(2,5-difluorophenyl)methyl]piperidin-4-ol (PubChem CID 24904993) has the molecular formula C12H15F2NO and a molecular weight of 227.25 g/mol. Its IUPAC name is 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(2,5-difluorophenyl)methyl]piperidin-4-ol
PubChem CID24904993
Molecular FormulaC12H15F2NO
Molecular Weight227.25 g/mol
Exact Mass227.11
IUPAC Name1-[(2,5-difluorophenyl)methyl]piperidin-4-ol
SMILESOC1CCN(Cc2cc(F)ccc2F)CC1
InChIInChI=1S/C12H15F2NO/c13-10-1-2-12(14)9(7-10)8-15-5-3-11(16)4-6-15/h1-2,7,11,16H,3-6,8H2
InChIKeyKGADSJUJEGZYHI-UHFFFAOYSA-N
XLogP1.92
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-fluoro-3-[(4-hydroxypiperidin-1-yl)methyl]phenyl]boronic acid
CID 91758879
1-[1-[(2,5-difluorophenyl)methyl]piperidin-4-yl]ethanone
CID 63846321
1-[(2-fluorophenyl)methyl]piperidin-4-ol
CID 10242192
(3R)-1-[(5-bromo-2-fluorophenyl)methyl]pyrrolidin-3-ol
CID 78963344
1-[(2,5-difluorophenyl)methyl]-4-(imidazol-1-ylmethyl)piperidine
CID 90493839
cyclopentyl-[4-[(2,5-difluorophenyl)methyl]piperazin-1-yl]methanone
CID 23910095
N-[[1-[(2,5-difluorophenyl)methyl]piperidin-4-yl]methyl]propan-2-amine
CID 62593627
1-[[5-(aminomethyl)-2-fluorophenyl]methyl]pyrrolidin-3-ol
CID 62943367
4-fluoro-3-[(3-hydroxypyrrolidin-1-yl)methyl]benzoic acid
CID 107452258
1-[(5-fluoro-2-methoxyphenyl)methyl]pyrrolidin-3-ol
CID 62917327
4-[(2,5-difluorophenyl)methyl]cyclohexan-1-ol
CID 116928452
methyl 1-[(2,5-difluorophenyl)methyl]pyrrolidine-3-carboxylate
CID 112730829

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol (CID 24904993) is 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol is OC1CCN(Cc2cc(F)ccc2F)CC1.
What is the InChIKey of 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol?
The InChIKey is KGADSJUJEGZYHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2NO/c13-10-1-2-12(14)9(7-10)8-15-5-3-11(16)4-6-15/h1-2,7,11,16H,3-6,8H2.
What are the key properties of 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol?
1-[(2,5-difluorophenyl)methyl]piperidin-4-ol has a molecular weight of 227.25 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-difluorophenyl)methyl]piperidin-4-ol is sourced from PubChem (CID 24904993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).