5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine

C19H15N3O — CID 118486383

IUPAC5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine
SMILESc1ccc(-c2cc(NCc3cccnc3)c3occc3n2)cc1
InChIInChI=1S/C19H15N3O/c1-2-6-15(7-3-1)17-11-18(19-16(22-17)8-10-23-19)21-13-14-5-4-9-20-12-14/h1-12H,13H2,(H,21,22)
InChIKeyXFYIAINDVWDJDA-UHFFFAOYSA-N
MW301.35 g/mol
LogP4.50
Rot. Bonds4

About 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine

5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine (PubChem CID 118486383) has the molecular formula C19H15N3O and a molecular weight of 301.35 g/mol. Its IUPAC name is 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine.

Molecular Properties

Compound Name5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine
PubChem CID118486383
Molecular FormulaC19H15N3O
Molecular Weight301.35 g/mol
Exact Mass301.12
IUPAC Name5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine
SMILESc1ccc(-c2cc(NCc3cccnc3)c3occc3n2)cc1
InChIInChI=1S/C19H15N3O/c1-2-6-15(7-3-1)17-11-18(19-16(22-17)8-10-23-19)21-13-14-5-4-9-20-12-14/h1-12H,13H2,(H,21,22)
InChIKeyXFYIAINDVWDJDA-UHFFFAOYSA-N
XLogP4.50
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine?
The IUPAC name of 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine (CID 118486383) is 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine.
What is the SMILES notation for 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine?
The canonical SMILES for 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine is c1ccc(-c2cc(NCc3cccnc3)c3occc3n2)cc1.
What is the InChIKey of 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine?
The InChIKey is XFYIAINDVWDJDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O/c1-2-6-15(7-3-1)17-11-18(19-16(22-17)8-10-23-19)21-13-14-5-4-9-20-12-14/h1-12H,13H2,(H,21,22).
What are the key properties of 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine?
5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine has a molecular weight of 301.35 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-(pyridin-3-ylmethyl)furo[3,2-b]pyridin-7-amine is sourced from PubChem (CID 118486383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).