4-pyridin-4-yloxybenzene-1,3-diol

C11H9NO3 — CID 139941963

IUPAC4-pyridin-4-yloxybenzene-1,3-diol
SMILESOc1ccc(Oc2ccncc2)c(O)c1
InChIInChI=1S/C11H9NO3/c13-8-1-2-11(10(14)7-8)15-9-3-5-12-6-4-9/h1-7,13-14H
InChIKeyIXJBDXCHGIXFHE-UHFFFAOYSA-N
MW203.20 g/mol
LogP2.29
Rot. Bonds2

About 4-pyridin-4-yloxybenzene-1,3-diol

4-pyridin-4-yloxybenzene-1,3-diol (PubChem CID 139941963) has the molecular formula C11H9NO3 and a molecular weight of 203.20 g/mol. Its IUPAC name is 4-pyridin-4-yloxybenzene-1,3-diol.

Molecular Properties

Compound Name4-pyridin-4-yloxybenzene-1,3-diol
PubChem CID139941963
Molecular FormulaC11H9NO3
Molecular Weight203.20 g/mol
Exact Mass203.06
IUPAC Name4-pyridin-4-yloxybenzene-1,3-diol
SMILESOc1ccc(Oc2ccncc2)c(O)c1
InChIInChI=1S/C11H9NO3/c13-8-1-2-11(10(14)7-8)15-9-3-5-12-6-4-9/h1-7,13-14H
InChIKeyIXJBDXCHGIXFHE-UHFFFAOYSA-N
XLogP2.29
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,4-dihydroxyphenoxy)benzene-1,3-diol
CID 19427119
3-phenoxybenzene-1,2-diol;4-phenoxybenzene-1,3-diol
CID 70468800
2-methyl-3-pyridin-4-yloxyphenol
CID 60871245
4-[4-(2-pyrrolidin-1-ylethoxy)phenoxy]benzene-1,3-diol
CID 173275765
3,4-bis(4-methoxyphenoxy)phenol
CID 139941919
2-[3-hydroxy-5-[2-(4-hydroxyphenyl)ethyl]phenoxy]-5-[2-(4-hydroxyphenyl)ethyl]phenol
CID 172871207
3-chloro-4-pyridin-4-yloxybenzoic acid;hydrochloride
CID 54593353
4,6-diphenoxybenzene-1,3-diol
CID 90212443
2-(4-hydroxyphenoxy)benzene-1,3,5-triol
CID 14020522
3-amino-4-pyridin-4-yloxybenzonitrile
CID 61388507
4-bromo-3-pyridin-4-yloxyaniline
CID 103011740
3-bromo-4-(3-bromo-4-hydroxyphenoxy)phenol
CID 18930859

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-4-yloxybenzene-1,3-diol?
The IUPAC name of 4-pyridin-4-yloxybenzene-1,3-diol (CID 139941963) is 4-pyridin-4-yloxybenzene-1,3-diol.
What is the SMILES notation for 4-pyridin-4-yloxybenzene-1,3-diol?
The canonical SMILES for 4-pyridin-4-yloxybenzene-1,3-diol is Oc1ccc(Oc2ccncc2)c(O)c1.
What is the InChIKey of 4-pyridin-4-yloxybenzene-1,3-diol?
The InChIKey is IXJBDXCHGIXFHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO3/c13-8-1-2-11(10(14)7-8)15-9-3-5-12-6-4-9/h1-7,13-14H.
What are the key properties of 4-pyridin-4-yloxybenzene-1,3-diol?
4-pyridin-4-yloxybenzene-1,3-diol has a molecular weight of 203.20 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-4-yloxybenzene-1,3-diol is sourced from PubChem (CID 139941963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).