2-methoxy-4-quinolin-8-yloxyaniline

C16H14N2O2 — CID 63678209

IUPAC2-methoxy-4-quinolin-8-yloxyaniline
SMILESCOc1cc(Oc2cccc3cccnc23)ccc1N
InChIInChI=1S/C16H14N2O2/c1-19-15-10-12(7-8-13(15)17)20-14-6-2-4-11-5-3-9-18-16(11)14/h2-10H,17H2,1H3
InChIKeyGYLJMAMHSURGOQ-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.62
Rot. Bonds3

About 2-methoxy-4-quinolin-8-yloxyaniline

2-methoxy-4-quinolin-8-yloxyaniline (PubChem CID 63678209) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-methoxy-4-quinolin-8-yloxyaniline.

Molecular Properties

Compound Name2-methoxy-4-quinolin-8-yloxyaniline
PubChem CID63678209
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-methoxy-4-quinolin-8-yloxyaniline
SMILESCOc1cc(Oc2cccc3cccnc23)ccc1N
InChIInChI=1S/C16H14N2O2/c1-19-15-10-12(7-8-13(15)17)20-14-6-2-4-11-5-3-9-18-16(11)14/h2-10H,17H2,1H3
InChIKeyGYLJMAMHSURGOQ-UHFFFAOYSA-N
XLogP3.62
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-quinolin-8-yloxyaniline?
The IUPAC name of 2-methoxy-4-quinolin-8-yloxyaniline (CID 63678209) is 2-methoxy-4-quinolin-8-yloxyaniline.
What is the SMILES notation for 2-methoxy-4-quinolin-8-yloxyaniline?
The canonical SMILES for 2-methoxy-4-quinolin-8-yloxyaniline is COc1cc(Oc2cccc3cccnc23)ccc1N.
What is the InChIKey of 2-methoxy-4-quinolin-8-yloxyaniline?
The InChIKey is GYLJMAMHSURGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-19-15-10-12(7-8-13(15)17)20-14-6-2-4-11-5-3-9-18-16(11)14/h2-10H,17H2,1H3.
What are the key properties of 2-methoxy-4-quinolin-8-yloxyaniline?
2-methoxy-4-quinolin-8-yloxyaniline has a molecular weight of 266.30 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-quinolin-8-yloxyaniline is sourced from PubChem (CID 63678209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).