5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride

C17H16ClNO2 — CID 6603466

IUPAC5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride
SMILESCl.Oc1ccc(COCc2ccccc2)c2cccnc12
InChIInChI=1S/C17H15NO2.ClH/c19-16-9-8-14(15-7-4-10-18-17(15)16)12-20-11-13-5-2-1-3-6-13;/h1-10,19H,11-12H2;1H
InChIKeyZHDHOHOGEBIQRP-UHFFFAOYSA-N
MW301.77 g/mol
LogP4.08
Rot. Bonds4

About 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride

5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride (PubChem CID 6603466) has the molecular formula C17H16ClNO2 and a molecular weight of 301.77 g/mol. Its IUPAC name is 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride.

Molecular Properties

Compound Name5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride
PubChem CID6603466
Molecular FormulaC17H16ClNO2
Molecular Weight301.77 g/mol
Exact Mass301.09
IUPAC Name5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride
SMILESCl.Oc1ccc(COCc2ccccc2)c2cccnc12
InChIInChI=1S/C17H15NO2.ClH/c19-16-9-8-14(15-7-4-10-18-17(15)16)12-20-11-13-5-2-1-3-6-13;/h1-10,19H,11-12H2;1H
InChIKeyZHDHOHOGEBIQRP-UHFFFAOYSA-N
XLogP4.08
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.77
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride?
The IUPAC name of 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride (CID 6603466) is 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride.
What is the SMILES notation for 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride?
The canonical SMILES for 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride is Cl.Oc1ccc(COCc2ccccc2)c2cccnc12.
What is the InChIKey of 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride?
The InChIKey is ZHDHOHOGEBIQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2.ClH/c19-16-9-8-14(15-7-4-10-18-17(15)16)12-20-11-13-5-2-1-3-6-13;/h1-10,19H,11-12H2;1H.
What are the key properties of 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride?
5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride has a molecular weight of 301.77 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(phenylmethoxymethyl)quinolin-8-ol;hydrochloride is sourced from PubChem (CID 6603466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).