7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol

C22H19N3O — CID 58543223

IUPAC7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol
SMILESCc1cccc(CC(c2ccncc2)c2ccc3cccnc3c2O)n1
InChIInChI=1S/C22H19N3O/c1-15-4-2-6-18(25-15)14-20(16-9-12-23-13-10-16)19-8-7-17-5-3-11-24-21(17)22(19)26/h2-13,20,26H,14H2,1H3
InChIKeyVKXBVMZLOXJHRV-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.41
Rot. Bonds4

About 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol

7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol (PubChem CID 58543223) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol
PubChem CID58543223
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol
SMILESCc1cccc(CC(c2ccncc2)c2ccc3cccnc3c2O)n1
InChIInChI=1S/C22H19N3O/c1-15-4-2-6-18(25-15)14-20(16-9-12-23-13-10-16)19-8-7-17-5-3-11-24-21(17)22(19)26/h2-13,20,26H,14H2,1H3
InChIKeyVKXBVMZLOXJHRV-UHFFFAOYSA-N
XLogP4.41
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol?
The IUPAC name of 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol (CID 58543223) is 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol.
What is the SMILES notation for 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol?
The canonical SMILES for 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol is Cc1cccc(CC(c2ccncc2)c2ccc3cccnc3c2O)n1.
What is the InChIKey of 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol?
The InChIKey is VKXBVMZLOXJHRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-15-4-2-6-18(25-15)14-20(16-9-12-23-13-10-16)19-8-7-17-5-3-11-24-21(17)22(19)26/h2-13,20,26H,14H2,1H3.
What are the key properties of 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol?
7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol has a molecular weight of 341.41 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(6-methyl-2-pyridinyl)-1-pyridin-4-ylethyl]quinolin-8-ol is sourced from PubChem (CID 58543223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).