2-benzylindazol-5-ol

C14H12N2O — CID 118954464

IUPAC2-benzylindazol-5-ol
SMILESOc1ccc2nn(Cc3ccccc3)cc2c1
InChIInChI=1S/C14H12N2O/c17-13-6-7-14-12(8-13)10-16(15-14)9-11-4-2-1-3-5-11/h1-8,10,17H,9H2
InChIKeyNHHZQRJMNAGNNX-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.79
Rot. Bonds2

About 2-benzylindazol-5-ol

2-benzylindazol-5-ol (PubChem CID 118954464) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-benzylindazol-5-ol.

Molecular Properties

Compound Name2-benzylindazol-5-ol
PubChem CID118954464
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-benzylindazol-5-ol
SMILESOc1ccc2nn(Cc3ccccc3)cc2c1
InChIInChI=1S/C14H12N2O/c17-13-6-7-14-12(8-13)10-16(15-14)9-11-4-2-1-3-5-11/h1-8,10,17H,9H2
InChIKeyNHHZQRJMNAGNNX-UHFFFAOYSA-N
XLogP2.79
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzylindazol-5-ol?
The IUPAC name of 2-benzylindazol-5-ol (CID 118954464) is 2-benzylindazol-5-ol.
What is the SMILES notation for 2-benzylindazol-5-ol?
The canonical SMILES for 2-benzylindazol-5-ol is Oc1ccc2nn(Cc3ccccc3)cc2c1.
What is the InChIKey of 2-benzylindazol-5-ol?
The InChIKey is NHHZQRJMNAGNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c17-13-6-7-14-12(8-13)10-16(15-14)9-11-4-2-1-3-5-11/h1-8,10,17H,9H2.
What are the key properties of 2-benzylindazol-5-ol?
2-benzylindazol-5-ol has a molecular weight of 224.26 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzylindazol-5-ol is sourced from PubChem (CID 118954464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).