6-(4-fluorophenoxy)-1H-indazol-3-amine

C13H10FN3O — CID 170994529

IUPAC6-(4-fluorophenoxy)-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(Oc3ccc(F)cc3)ccc12
InChIInChI=1S/C13H10FN3O/c14-8-1-3-9(4-2-8)18-10-5-6-11-12(7-10)16-17-13(11)15/h1-7H,(H3,15,16,17)
InChIKeyOYEWHHAIPAZUFD-UHFFFAOYSA-N
MW243.24 g/mol
LogP3.08
Rot. Bonds2

About 6-(4-fluorophenoxy)-1H-indazol-3-amine

6-(4-fluorophenoxy)-1H-indazol-3-amine (PubChem CID 170994529) has the molecular formula C13H10FN3O and a molecular weight of 243.24 g/mol. Its IUPAC name is 6-(4-fluorophenoxy)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(4-fluorophenoxy)-1H-indazol-3-amine
PubChem CID170994529
Molecular FormulaC13H10FN3O
Molecular Weight243.24 g/mol
Exact Mass243.08
IUPAC Name6-(4-fluorophenoxy)-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(Oc3ccc(F)cc3)ccc12
InChIInChI=1S/C13H10FN3O/c14-8-1-3-9(4-2-8)18-10-5-6-11-12(7-10)16-17-13(11)15/h1-7H,(H3,15,16,17)
InChIKeyOYEWHHAIPAZUFD-UHFFFAOYSA-N
XLogP3.08
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenoxy)-1H-indazol-3-amine?
The IUPAC name of 6-(4-fluorophenoxy)-1H-indazol-3-amine (CID 170994529) is 6-(4-fluorophenoxy)-1H-indazol-3-amine.
What is the SMILES notation for 6-(4-fluorophenoxy)-1H-indazol-3-amine?
The canonical SMILES for 6-(4-fluorophenoxy)-1H-indazol-3-amine is Nc1n[nH]c2cc(Oc3ccc(F)cc3)ccc12.
What is the InChIKey of 6-(4-fluorophenoxy)-1H-indazol-3-amine?
The InChIKey is OYEWHHAIPAZUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O/c14-8-1-3-9(4-2-8)18-10-5-6-11-12(7-10)16-17-13(11)15/h1-7H,(H3,15,16,17).
What are the key properties of 6-(4-fluorophenoxy)-1H-indazol-3-amine?
6-(4-fluorophenoxy)-1H-indazol-3-amine has a molecular weight of 243.24 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenoxy)-1H-indazol-3-amine is sourced from PubChem (CID 170994529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).