5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol

C16H15N3O — CID 830236

IUPAC5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol
SMILESCc1cccc(NCc2ccc(O)c3ncccc23)n1
InChIInChI=1S/C16H15N3O/c1-11-4-2-6-15(19-11)18-10-12-7-8-14(20)16-13(12)5-3-9-17-16/h2-9,20H,10H2,1H3,(H,18,19)
InChIKeyBJESPHSCSQTISN-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.26
Rot. Bonds3

About 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol

5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol (PubChem CID 830236) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol.

Molecular Properties

Compound Name5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol
PubChem CID830236
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol
SMILESCc1cccc(NCc2ccc(O)c3ncccc23)n1
InChIInChI=1S/C16H15N3O/c1-11-4-2-6-15(19-11)18-10-12-7-8-14(20)16-13(12)5-3-9-17-16/h2-9,20H,10H2,1H3,(H,18,19)
InChIKeyBJESPHSCSQTISN-UHFFFAOYSA-N
XLogP3.26
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol 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-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol?
The IUPAC name of 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol (CID 830236) is 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol.
What is the SMILES notation for 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol?
The canonical SMILES for 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol is Cc1cccc(NCc2ccc(O)c3ncccc23)n1.
What is the InChIKey of 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol?
The InChIKey is BJESPHSCSQTISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11-4-2-6-15(19-11)18-10-12-7-8-14(20)16-13(12)5-3-9-17-16/h2-9,20H,10H2,1H3,(H,18,19).
What are the key properties of 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol?
5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol has a molecular weight of 265.32 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(6-methyl-2-pyridinyl)amino]methyl]quinolin-8-ol is sourced from PubChem (CID 830236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).