7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol

C19H19N3O2 — CID 2999043

IUPAC7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol
SMILESOc1c(C(c2ccccn2)N2CCOCC2)ccc2cccnc12
InChIInChI=1S/C19H19N3O2/c23-19-15(7-6-14-4-3-9-21-17(14)19)18(16-5-1-2-8-20-16)22-10-12-24-13-11-22/h1-9,18,23H,10-13H2
InChIKeyTWVUZMQFOHDXGV-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.76
Rot. Bonds3

About 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol

7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol (PubChem CID 2999043) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol
PubChem CID2999043
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol
SMILESOc1c(C(c2ccccn2)N2CCOCC2)ccc2cccnc12
InChIInChI=1S/C19H19N3O2/c23-19-15(7-6-14-4-3-9-21-17(14)19)18(16-5-1-2-8-20-16)22-10-12-24-13-11-22/h1-9,18,23H,10-13H2
InChIKeyTWVUZMQFOHDXGV-UHFFFAOYSA-N
XLogP2.76
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol?
The IUPAC name of 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol (CID 2999043) is 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol.
What is the SMILES notation for 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol?
The canonical SMILES for 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol is Oc1c(C(c2ccccn2)N2CCOCC2)ccc2cccnc12.
What is the InChIKey of 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol?
The InChIKey is TWVUZMQFOHDXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c23-19-15(7-6-14-4-3-9-21-17(14)19)18(16-5-1-2-8-20-16)22-10-12-24-13-11-22/h1-9,18,23H,10-13H2.
What are the key properties of 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol?
7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol has a molecular weight of 321.38 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[morpholin-4-yl(pyridin-2-yl)methyl]quinolin-8-ol is sourced from PubChem (CID 2999043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).