8-(4-ethoxyphenoxy)quinolin-4-amine

C17H16N2O2 — CID 62191521

IUPAC8-(4-ethoxyphenoxy)quinolin-4-amine
SMILESCCOc1ccc(Oc2cccc3c(N)ccnc23)cc1
InChIInChI=1S/C17H16N2O2/c1-2-20-12-6-8-13(9-7-12)21-16-5-3-4-14-15(18)10-11-19-17(14)16/h3-11H,2H2,1H3,(H2,18,19)
InChIKeyBVQFBPQYMXIDDK-UHFFFAOYSA-N
MW280.33 g/mol
LogP4.01
Rot. Bonds4

About 8-(4-ethoxyphenoxy)quinolin-4-amine

8-(4-ethoxyphenoxy)quinolin-4-amine (PubChem CID 62191521) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 8-(4-ethoxyphenoxy)quinolin-4-amine.

Molecular Properties

Compound Name8-(4-ethoxyphenoxy)quinolin-4-amine
PubChem CID62191521
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name8-(4-ethoxyphenoxy)quinolin-4-amine
SMILESCCOc1ccc(Oc2cccc3c(N)ccnc23)cc1
InChIInChI=1S/C17H16N2O2/c1-2-20-12-6-8-13(9-7-12)21-16-5-3-4-14-15(18)10-11-19-17(14)16/h3-11H,2H2,1H3,(H2,18,19)
InChIKeyBVQFBPQYMXIDDK-UHFFFAOYSA-N
XLogP4.01
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-(4-ethoxyphenoxy)quinolin-4-amine?
The IUPAC name of 8-(4-ethoxyphenoxy)quinolin-4-amine (CID 62191521) is 8-(4-ethoxyphenoxy)quinolin-4-amine.
What is the SMILES notation for 8-(4-ethoxyphenoxy)quinolin-4-amine?
The canonical SMILES for 8-(4-ethoxyphenoxy)quinolin-4-amine is CCOc1ccc(Oc2cccc3c(N)ccnc23)cc1.
What is the InChIKey of 8-(4-ethoxyphenoxy)quinolin-4-amine?
The InChIKey is BVQFBPQYMXIDDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-2-20-12-6-8-13(9-7-12)21-16-5-3-4-14-15(18)10-11-19-17(14)16/h3-11H,2H2,1H3,(H2,18,19).
What are the key properties of 8-(4-ethoxyphenoxy)quinolin-4-amine?
8-(4-ethoxyphenoxy)quinolin-4-amine has a molecular weight of 280.33 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-ethoxyphenoxy)quinolin-4-amine is sourced from PubChem (CID 62191521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).