7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol

C24H22N2O2 — CID 58542699

IUPAC7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol
SMILESCc1ccc(O)c(C(Cc2cccc(C)n2)c2ccc3cccnc3c2O)c1
InChIInChI=1S/C24H22N2O2/c1-15-8-11-22(27)21(13-15)20(14-18-7-3-5-16(2)26-18)19-10-9-17-6-4-12-25-23(17)24(19)28/h3-13,20,27-28H,14H2,1-2H3
InChIKeyFKNCHADLLBNYAT-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.03
Rot. Bonds4

About 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol

7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol (PubChem CID 58542699) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol
PubChem CID58542699
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol
SMILESCc1ccc(O)c(C(Cc2cccc(C)n2)c2ccc3cccnc3c2O)c1
InChIInChI=1S/C24H22N2O2/c1-15-8-11-22(27)21(13-15)20(14-18-7-3-5-16(2)26-18)19-10-9-17-6-4-12-25-23(17)24(19)28/h3-13,20,27-28H,14H2,1-2H3
InChIKeyFKNCHADLLBNYAT-UHFFFAOYSA-N
XLogP5.03
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.45
LogP ≤ 55.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol?
The IUPAC name of 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol (CID 58542699) is 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol.
What is the SMILES notation for 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol?
The canonical SMILES for 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol is Cc1ccc(O)c(C(Cc2cccc(C)n2)c2ccc3cccnc3c2O)c1.
What is the InChIKey of 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol?
The InChIKey is FKNCHADLLBNYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-15-8-11-22(27)21(13-15)20(14-18-7-3-5-16(2)26-18)19-10-9-17-6-4-12-25-23(17)24(19)28/h3-13,20,27-28H,14H2,1-2H3.
What are the key properties of 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol?
7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol has a molecular weight of 370.45 g/mol, XLogP of 5.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(2-hydroxy-5-methylphenyl)-2-(6-methyl-2-pyridinyl)ethyl]quinolin-8-ol is sourced from PubChem (CID 58542699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).