(6-quinolin-7-yloxy-3-pyridinyl)methanamine

C15H13N3O — CID 107313109

IUPAC(6-quinolin-7-yloxy-3-pyridinyl)methanamine
SMILESNCc1ccc(Oc2ccc3cccnc3c2)nc1
InChIInChI=1S/C15H13N3O/c16-9-11-3-6-15(18-10-11)19-13-5-4-12-2-1-7-17-14(12)8-13/h1-8,10H,9,16H2
InChIKeyOKPTVJDAGWTCRQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.88
Rot. Bonds3

About (6-quinolin-7-yloxy-3-pyridinyl)methanamine

(6-quinolin-7-yloxy-3-pyridinyl)methanamine (PubChem CID 107313109) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is (6-quinolin-7-yloxy-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(6-quinolin-7-yloxy-3-pyridinyl)methanamine
PubChem CID107313109
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name(6-quinolin-7-yloxy-3-pyridinyl)methanamine
SMILESNCc1ccc(Oc2ccc3cccnc3c2)nc1
InChIInChI=1S/C15H13N3O/c16-9-11-3-6-15(18-10-11)19-13-5-4-12-2-1-7-17-14(12)8-13/h1-8,10H,9,16H2
InChIKeyOKPTVJDAGWTCRQ-UHFFFAOYSA-N
XLogP2.88
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-quinolin-7-yloxy-3-pyridinyl)methanamine?
The IUPAC name of (6-quinolin-7-yloxy-3-pyridinyl)methanamine (CID 107313109) is (6-quinolin-7-yloxy-3-pyridinyl)methanamine.
What is the SMILES notation for (6-quinolin-7-yloxy-3-pyridinyl)methanamine?
The canonical SMILES for (6-quinolin-7-yloxy-3-pyridinyl)methanamine is NCc1ccc(Oc2ccc3cccnc3c2)nc1.
What is the InChIKey of (6-quinolin-7-yloxy-3-pyridinyl)methanamine?
The InChIKey is OKPTVJDAGWTCRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c16-9-11-3-6-15(18-10-11)19-13-5-4-12-2-1-7-17-14(12)8-13/h1-8,10H,9,16H2.
What are the key properties of (6-quinolin-7-yloxy-3-pyridinyl)methanamine?
(6-quinolin-7-yloxy-3-pyridinyl)methanamine has a molecular weight of 251.29 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-quinolin-7-yloxy-3-pyridinyl)methanamine is sourced from PubChem (CID 107313109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).