4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol

C13H13NO2 — CID 136623405

IUPAC4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol
SMILESCc1cc(O)ccc1-c1cc(CO)ccn1
InChIInChI=1S/C13H13NO2/c1-9-6-11(16)2-3-12(9)13-7-10(8-15)4-5-14-13/h2-7,15-16H,8H2,1H3
InChIKeyGJVNEUQUQOFYFI-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.25
Rot. Bonds2

About 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol

4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol (PubChem CID 136623405) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol.

Molecular Properties

Compound Name4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol
PubChem CID136623405
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol
SMILESCc1cc(O)ccc1-c1cc(CO)ccn1
InChIInChI=1S/C13H13NO2/c1-9-6-11(16)2-3-12(9)13-7-10(8-15)4-5-14-13/h2-7,15-16H,8H2,1H3
InChIKeyGJVNEUQUQOFYFI-UHFFFAOYSA-N
XLogP2.25
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tris([2-[4-(hydroxymethyl)-2-pyridinyl]-4-pyridinyl]methanol);ruthenium(2+);dichloride
CID 170900756
[2-(2,4-dimethylphenyl)-4-pyridinyl]methanethiol
CID 58401383
(2-methyl-4-pyridinyl)methanol;hydrochloride
CID 171364039
4-(4-ethylphenyl)-3-methylphenol
CID 83130010
[2-[2-(hydroxymethyl)-4-[2-methyl-4,6-bis(trifluoromethyl)phenyl]phenyl]-4-pyridinyl]methanol
CID 58401318
(3-methyl-4-quinolin-2-ylphenyl)methanol
CID 170986628
2-(2,4-dimethylphenyl)-4-fluoropyridine
CID 102824457
[2-[2,3-bis(methylaminomethyl)phenyl]-4-pyridinyl]methanol
CID 58401575
[2-[4-(aminomethyl)phenyl]-4-pyridinyl]methanol
CID 150361039
[2-(1H-imidazol-2-yl)-4-pyridinyl]methanol
CID 104831040
[2-[2-(trifluoromethoxy)phenyl]-4-pyridinyl]methanol
CID 118802410
4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
CID 137012596

Frequently Asked Questions

What is the IUPAC name of 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol?
The IUPAC name of 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol (CID 136623405) is 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol.
What is the SMILES notation for 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol?
The canonical SMILES for 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol is Cc1cc(O)ccc1-c1cc(CO)ccn1.
What is the InChIKey of 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol?
The InChIKey is GJVNEUQUQOFYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-9-6-11(16)2-3-12(9)13-7-10(8-15)4-5-14-13/h2-7,15-16H,8H2,1H3.
What are the key properties of 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol?
4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol has a molecular weight of 215.25 g/mol, XLogP of 2.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(hydroxymethyl)-2-pyridinyl]-3-methylphenol is sourced from PubChem (CID 136623405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).