2-[4-(hydroxymethyl)piperidin-1-yl]phenol

C12H17NO2 — CID 71530927

IUPAC2-[4-(hydroxymethyl)piperidin-1-yl]phenol
SMILESOCC1CCN(c2ccccc2O)CC1
InChIInChI=1S/C12H17NO2/c14-9-10-5-7-13(8-6-10)11-3-1-2-4-12(11)15/h1-4,10,14-15H,5-9H2
InChIKeyIBXBKJGARYOHQW-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.60
Rot. Bonds2

About 2-[4-(hydroxymethyl)piperidin-1-yl]phenol

2-[4-(hydroxymethyl)piperidin-1-yl]phenol (PubChem CID 71530927) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)piperidin-1-yl]phenol.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)piperidin-1-yl]phenol
PubChem CID71530927
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-[4-(hydroxymethyl)piperidin-1-yl]phenol
SMILESOCC1CCN(c2ccccc2O)CC1
InChIInChI=1S/C12H17NO2/c14-9-10-5-7-13(8-6-10)11-3-1-2-4-12(11)15/h1-4,10,14-15H,5-9H2
InChIKeyIBXBKJGARYOHQW-UHFFFAOYSA-N
XLogP1.60
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-ethylphenyl)piperidin-4-yl]methanol
CID 117027933
3-[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]propan-1-ol
CID 170887594
[1-[2-[1-(methylamino)ethyl]phenyl]piperidin-4-yl]methanol
CID 43284506
[1-[2-(trifluoromethylsulfonyl)phenyl]piperidin-4-yl]methanol
CID 56796829
[1-(2-amino-3-fluorophenyl)piperidin-4-yl]methanol
CID 60790060
[1-[2-(2,3-dihydro-1H-inden-2-ylmethylamino)phenyl]piperidin-4-yl]methanol
CID 126803823
[1-[2-[1-(methylamino)propyl]phenyl]piperidin-4-yl]methanol
CID 112677818
[1-[2-(4,5-dihydro-1H-imidazol-2-yl)phenyl]piperidin-4-yl]methanol
CID 82245811
N-[2-[4-(hydroxymethyl)piperidin-1-yl]phenyl]prop-2-enamide
CID 166414486
N-ethyl-2-[4-(hydroxymethyl)piperidin-1-yl]benzenesulfonamide
CID 61146535
[(3S)-1-phenylpyrrolidin-3-yl]methanol
CID 42258987
[1-[2-(dimethylamino)phenyl]pyrrolidin-3-yl]methanol
CID 106760827

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]phenol?
The IUPAC name of 2-[4-(hydroxymethyl)piperidin-1-yl]phenol (CID 71530927) is 2-[4-(hydroxymethyl)piperidin-1-yl]phenol.
What is the SMILES notation for 2-[4-(hydroxymethyl)piperidin-1-yl]phenol?
The canonical SMILES for 2-[4-(hydroxymethyl)piperidin-1-yl]phenol is OCC1CCN(c2ccccc2O)CC1.
What is the InChIKey of 2-[4-(hydroxymethyl)piperidin-1-yl]phenol?
The InChIKey is IBXBKJGARYOHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c14-9-10-5-7-13(8-6-10)11-3-1-2-4-12(11)15/h1-4,10,14-15H,5-9H2.
What are the key properties of 2-[4-(hydroxymethyl)piperidin-1-yl]phenol?
2-[4-(hydroxymethyl)piperidin-1-yl]phenol has a molecular weight of 207.27 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)piperidin-1-yl]phenol is sourced from PubChem (CID 71530927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).