2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol

C13H15N3O — CID 83893722

IUPAC2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol
SMILESNC1CCc2c(cnn2-c2ccccc2O)C1
InChIInChI=1S/C13H15N3O/c14-10-5-6-11-9(7-10)8-15-16(11)12-3-1-2-4-13(12)17/h1-4,8,10,17H,5-7,14H2
InChIKeyCGIZRPKIXPKUNA-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.39
Rot. Bonds1

About 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol

2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol (PubChem CID 83893722) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol.

Molecular Properties

Compound Name2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol
PubChem CID83893722
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol
SMILESNC1CCc2c(cnn2-c2ccccc2O)C1
InChIInChI=1S/C13H15N3O/c14-10-5-6-11-9(7-10)8-15-16(11)12-3-1-2-4-13(12)17/h1-4,8,10,17H,5-7,14H2
InChIKeyCGIZRPKIXPKUNA-UHFFFAOYSA-N
XLogP1.39
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol?
The IUPAC name of 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol (CID 83893722) is 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol.
What is the SMILES notation for 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol?
The canonical SMILES for 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol is NC1CCc2c(cnn2-c2ccccc2O)C1.
What is the InChIKey of 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol?
The InChIKey is CGIZRPKIXPKUNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c14-10-5-6-11-9(7-10)8-15-16(11)12-3-1-2-4-13(12)17/h1-4,8,10,17H,5-7,14H2.
What are the key properties of 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol?
2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol has a molecular weight of 229.28 g/mol, XLogP of 1.39, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-4,5,6,7-tetrahydroindazol-1-yl)phenol is sourced from PubChem (CID 83893722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).