4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol

C16H16N2O3 — CID 135409962

IUPAC4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol
SMILESCCc1cc(-c2n[nH]c3cc(OC)ccc23)c(O)cc1O
InChIInChI=1S/C16H16N2O3/c1-3-9-6-12(15(20)8-14(9)19)16-11-5-4-10(21-2)7-13(11)17-18-16/h4-8,19-20H,3H2,1-2H3,(H,17,18)
InChIKeyOGURFCDTWGREKV-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.21
Rot. Bonds3

About 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol

4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol (PubChem CID 135409962) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol.

Molecular Properties

Compound Name4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol
PubChem CID135409962
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol
SMILESCCc1cc(-c2n[nH]c3cc(OC)ccc23)c(O)cc1O
InChIInChI=1S/C16H16N2O3/c1-3-9-6-12(15(20)8-14(9)19)16-11-5-4-10(21-2)7-13(11)17-18-16/h4-8,19-20H,3H2,1-2H3,(H,17,18)
InChIKeyOGURFCDTWGREKV-UHFFFAOYSA-N
XLogP3.21
TPSA78.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol?
The IUPAC name of 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol (CID 135409962) is 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol.
What is the SMILES notation for 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol?
The canonical SMILES for 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol is CCc1cc(-c2n[nH]c3cc(OC)ccc23)c(O)cc1O.
What is the InChIKey of 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol?
The InChIKey is OGURFCDTWGREKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-3-9-6-12(15(20)8-14(9)19)16-11-5-4-10(21-2)7-13(11)17-18-16/h4-8,19-20H,3H2,1-2H3,(H,17,18).
What are the key properties of 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol?
4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol has a molecular weight of 284.32 g/mol, XLogP of 3.21, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(6-methoxy-1H-indazol-3-yl)benzene-1,3-diol is sourced from PubChem (CID 135409962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).