2-(methyliminomethyl)quinolin-6-ol

C11H10N2O — CID 137452558

IUPAC2-(methyliminomethyl)quinolin-6-ol
SMILESC/N=C/c1ccc2cc(O)ccc2n1
InChIInChI=1S/C11H10N2O/c1-12-7-9-3-2-8-6-10(14)4-5-11(8)13-9/h2-7,14H,1H3/b12-7+
InChIKeyOSGLEMVHTHJASM-KPKJPENVSA-N
MW186.21 g/mol
LogP1.99
Rot. Bonds1

About 2-(methyliminomethyl)quinolin-6-ol

2-(methyliminomethyl)quinolin-6-ol (PubChem CID 137452558) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-(methyliminomethyl)quinolin-6-ol.

Molecular Properties

Compound Name2-(methyliminomethyl)quinolin-6-ol
PubChem CID137452558
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2-(methyliminomethyl)quinolin-6-ol
SMILESC/N=C/c1ccc2cc(O)ccc2n1
InChIInChI=1S/C11H10N2O/c1-12-7-9-3-2-8-6-10(14)4-5-11(8)13-9/h2-7,14H,1H3/b12-7+
InChIKeyOSGLEMVHTHJASM-KPKJPENVSA-N
XLogP1.99
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(methyliminomethyl)quinolin-6-ol?
The IUPAC name of 2-(methyliminomethyl)quinolin-6-ol (CID 137452558) is 2-(methyliminomethyl)quinolin-6-ol.
What is the SMILES notation for 2-(methyliminomethyl)quinolin-6-ol?
The canonical SMILES for 2-(methyliminomethyl)quinolin-6-ol is C/N=C/c1ccc2cc(O)ccc2n1.
What is the InChIKey of 2-(methyliminomethyl)quinolin-6-ol?
The InChIKey is OSGLEMVHTHJASM-KPKJPENVSA-N. The full InChI is InChI=1S/C11H10N2O/c1-12-7-9-3-2-8-6-10(14)4-5-11(8)13-9/h2-7,14H,1H3/b12-7+.
What are the key properties of 2-(methyliminomethyl)quinolin-6-ol?
2-(methyliminomethyl)quinolin-6-ol has a molecular weight of 186.21 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methyliminomethyl)quinolin-6-ol is sourced from PubChem (CID 137452558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).