4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol

C15H14N2O3 — CID 135438183

IUPAC4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol
SMILESCCn1nc(-c2ccc(O)cc2O)c2ccc(O)cc21
InChIInChI=1S/C15H14N2O3/c1-2-17-13-7-9(18)3-5-11(13)15(16-17)12-6-4-10(19)8-14(12)20/h3-8,18-20H,2H2,1H3
InChIKeyFPECYZJXGMTZAF-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.84
Rot. Bonds2

About 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol

4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol (PubChem CID 135438183) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol.

Molecular Properties

Compound Name4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol
PubChem CID135438183
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol
SMILESCCn1nc(-c2ccc(O)cc2O)c2ccc(O)cc21
InChIInChI=1S/C15H14N2O3/c1-2-17-13-7-9(18)3-5-11(13)15(16-17)12-6-4-10(19)8-14(12)20/h3-8,18-20H,2H2,1H3
InChIKeyFPECYZJXGMTZAF-UHFFFAOYSA-N
XLogP2.84
TPSA78.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

Way-169916
CID 135461982
4-(6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
CID 135566322
Phenol, 4-(7-methyl-1-propyl-1H-indazol-3-yl)-
CID 135511848
4-(1-cyclopentyl-7-fluoro-1H-indazol-3-yl)phenol
CID 135524867
4-[1-isopropyl-7-(trifluoromethyl)-1H-indazol-3-yl]phenol
CID 135428120
4-(1-(3-Fluorophenyl)-6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
CID 135492495
4-(1-cyclohexyl-6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
CID 135499972
4-[1-(3-chlorophenyl)-6-hydroxy-1H-indazol-3-yl]benzene-1,3-diol
CID 135500018
4-(1-(2,5-Dichlorophenyl)-6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
CID 135508451
4-(6-hydroxy-1-propyl-1H-indazol-3-yl)benzene-1,3-diol
CID 135511863
4-(6-Hydroxy-1-(2,2,2-trifluoroethyl)-1H-indazol-3-yl)benzene-1,3-diol
CID 135511929
4-(6-Hydroxy-1-(p-tolyl)-1H-indazol-3-yl)benzene-1,3-diol
CID 135511945

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol?
The IUPAC name of 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol (CID 135438183) is 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol.
What is the SMILES notation for 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol?
The canonical SMILES for 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol is CCn1nc(-c2ccc(O)cc2O)c2ccc(O)cc21.
What is the InChIKey of 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol?
The InChIKey is FPECYZJXGMTZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-2-17-13-7-9(18)3-5-11(13)15(16-17)12-6-4-10(19)8-14(12)20/h3-8,18-20H,2H2,1H3.
What are the key properties of 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol?
4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol has a molecular weight of 270.29 g/mol, XLogP of 2.84, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-6-hydroxyindazol-3-yl)benzene-1,3-diol is sourced from PubChem (CID 135438183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).