(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine

C16H15N3O — CID 107313902

IUPAC(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine
SMILESC[C@@H](N)c1ccnc(Oc2ccc3cccnc3c2)c1
InChIInChI=1S/C16H15N3O/c1-11(17)13-6-8-19-16(9-13)20-14-5-4-12-3-2-7-18-15(12)10-14/h2-11H,17H2,1H3/t11-/m1/s1
InChIKeyOQSOTAUNKVMETG-LLVKDONJSA-N
MW265.32 g/mol
LogP3.44
Rot. Bonds3

About (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine

(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine (PubChem CID 107313902) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine
PubChem CID107313902
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine
SMILESC[C@@H](N)c1ccnc(Oc2ccc3cccnc3c2)c1
InChIInChI=1S/C16H15N3O/c1-11(17)13-6-8-19-16(9-13)20-14-5-4-12-3-2-7-18-15(12)10-14/h2-11H,17H2,1H3/t11-/m1/s1
InChIKeyOQSOTAUNKVMETG-LLVKDONJSA-N
XLogP3.44
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine?
The IUPAC name of (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine (CID 107313902) is (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine.
What is the SMILES notation for (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine?
The canonical SMILES for (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine is C[C@@H](N)c1ccnc(Oc2ccc3cccnc3c2)c1.
What is the InChIKey of (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine?
The InChIKey is OQSOTAUNKVMETG-LLVKDONJSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11(17)13-6-8-19-16(9-13)20-14-5-4-12-3-2-7-18-15(12)10-14/h2-11H,17H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine?
(1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine has a molecular weight of 265.32 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-quinolin-7-yloxy-4-pyridinyl)ethanamine is sourced from PubChem (CID 107313902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).