4-(3-amino-1H-indazol-6-yl)phenol

C13H11N3O — CID 135466441

IUPAC4-(3-amino-1H-indazol-6-yl)phenol
SMILESNc1n[nH]c2cc(-c3ccc(O)cc3)ccc12
InChIInChI=1S/C13H11N3O/c14-13-11-6-3-9(7-12(11)15-16-13)8-1-4-10(17)5-2-8/h1-7,17H,(H3,14,15,16)
InChIKeyYQANENYEEBUTAO-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.52
Rot. Bonds1

About 4-(3-amino-1H-indazol-6-yl)phenol

4-(3-amino-1H-indazol-6-yl)phenol (PubChem CID 135466441) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-(3-amino-1H-indazol-6-yl)phenol.

Molecular Properties

Compound Name4-(3-amino-1H-indazol-6-yl)phenol
PubChem CID135466441
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name4-(3-amino-1H-indazol-6-yl)phenol
SMILESNc1n[nH]c2cc(-c3ccc(O)cc3)ccc12
InChIInChI=1S/C13H11N3O/c14-13-11-6-3-9(7-12(11)15-16-13)8-1-4-10(17)5-2-8/h1-7,17H,(H3,14,15,16)
InChIKeyYQANENYEEBUTAO-UHFFFAOYSA-N
XLogP2.52
TPSA74.93 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-1H-indazol-6-yl)phenol?
The IUPAC name of 4-(3-amino-1H-indazol-6-yl)phenol (CID 135466441) is 4-(3-amino-1H-indazol-6-yl)phenol.
What is the SMILES notation for 4-(3-amino-1H-indazol-6-yl)phenol?
The canonical SMILES for 4-(3-amino-1H-indazol-6-yl)phenol is Nc1n[nH]c2cc(-c3ccc(O)cc3)ccc12.
What is the InChIKey of 4-(3-amino-1H-indazol-6-yl)phenol?
The InChIKey is YQANENYEEBUTAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c14-13-11-6-3-9(7-12(11)15-16-13)8-1-4-10(17)5-2-8/h1-7,17H,(H3,14,15,16).
What are the key properties of 4-(3-amino-1H-indazol-6-yl)phenol?
4-(3-amino-1H-indazol-6-yl)phenol has a molecular weight of 225.25 g/mol, XLogP of 2.52, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-1H-indazol-6-yl)phenol is sourced from PubChem (CID 135466441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).