[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol

C20H21NO2 — CID 169420711

IUPAC[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol
SMILESCCOc1ccccc1-c1cc(C)c2ccc(CO)c(C)c2n1
InChIInChI=1S/C20H21NO2/c1-4-23-19-8-6-5-7-17(19)18-11-13(2)16-10-9-15(12-22)14(3)20(16)21-18/h5-11,22H,4,12H2,1-3H3
InChIKeyAXDHOCOSNXNKLX-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.41
Rot. Bonds4

About [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol

[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol (PubChem CID 169420711) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol.

Molecular Properties

Compound Name[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol
PubChem CID169420711
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol
SMILESCCOc1ccccc1-c1cc(C)c2ccc(CO)c(C)c2n1
InChIInChI=1S/C20H21NO2/c1-4-23-19-8-6-5-7-17(19)18-11-13(2)16-10-9-15(12-22)14(3)20(16)21-18/h5-11,22H,4,12H2,1-3H3
InChIKeyAXDHOCOSNXNKLX-UHFFFAOYSA-N
XLogP4.41
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol?
The IUPAC name of [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol (CID 169420711) is [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol.
What is the SMILES notation for [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol?
The canonical SMILES for [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol is CCOc1ccccc1-c1cc(C)c2ccc(CO)c(C)c2n1.
What is the InChIKey of [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol?
The InChIKey is AXDHOCOSNXNKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-4-23-19-8-6-5-7-17(19)18-11-13(2)16-10-9-15(12-22)14(3)20(16)21-18/h5-11,22H,4,12H2,1-3H3.
What are the key properties of [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol?
[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol has a molecular weight of 307.39 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol is sourced from PubChem (CID 169420711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).