5-benzyl-1-phenylindazol-4-ol

C20H16N2O — CID 135705548

IUPAC5-benzyl-1-phenylindazol-4-ol
SMILESOc1c(Cc2ccccc2)ccc2c1cnn2-c1ccccc1
InChIInChI=1S/C20H16N2O/c23-20-16(13-15-7-3-1-4-8-15)11-12-19-18(20)14-21-22(19)17-9-5-2-6-10-17/h1-12,14,23H,13H2
InChIKeyYUSSEKWKPFRJBF-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.32
Rot. Bonds3

About 5-benzyl-1-phenylindazol-4-ol

5-benzyl-1-phenylindazol-4-ol (PubChem CID 135705548) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 5-benzyl-1-phenylindazol-4-ol.

Molecular Properties

Compound Name5-benzyl-1-phenylindazol-4-ol
PubChem CID135705548
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name5-benzyl-1-phenylindazol-4-ol
SMILESOc1c(Cc2ccccc2)ccc2c1cnn2-c1ccccc1
InChIInChI=1S/C20H16N2O/c23-20-16(13-15-7-3-1-4-8-15)11-12-19-18(20)14-21-22(19)17-9-5-2-6-10-17/h1-12,14,23H,13H2
InChIKeyYUSSEKWKPFRJBF-UHFFFAOYSA-N
XLogP4.32
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-1-phenylindazol-4-ol?
The IUPAC name of 5-benzyl-1-phenylindazol-4-ol (CID 135705548) is 5-benzyl-1-phenylindazol-4-ol.
What is the SMILES notation for 5-benzyl-1-phenylindazol-4-ol?
The canonical SMILES for 5-benzyl-1-phenylindazol-4-ol is Oc1c(Cc2ccccc2)ccc2c1cnn2-c1ccccc1.
What is the InChIKey of 5-benzyl-1-phenylindazol-4-ol?
The InChIKey is YUSSEKWKPFRJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c23-20-16(13-15-7-3-1-4-8-15)11-12-19-18(20)14-21-22(19)17-9-5-2-6-10-17/h1-12,14,23H,13H2.
What are the key properties of 5-benzyl-1-phenylindazol-4-ol?
5-benzyl-1-phenylindazol-4-ol has a molecular weight of 300.36 g/mol, XLogP of 4.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-1-phenylindazol-4-ol is sourced from PubChem (CID 135705548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).