6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine

C20H15FN4 — CID 175829223

IUPAC6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine
SMILESFc1cccc(-c2cc3ccnc(NCc4cccnc4)c3cn2)c1
InChIInChI=1S/C20H15FN4/c21-17-5-1-4-16(9-17)19-10-15-6-8-23-20(18(15)13-24-19)25-12-14-3-2-7-22-11-14/h1-11,13H,12H2,(H,23,25)
InChIKeyUNQGQNZSHDUOFW-UHFFFAOYSA-N
MW330.37 g/mol
LogP4.44
Rot. Bonds4

About 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine

6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine (PubChem CID 175829223) has the molecular formula C20H15FN4 and a molecular weight of 330.37 g/mol. Its IUPAC name is 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine.

Molecular Properties

Compound Name6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine
PubChem CID175829223
Molecular FormulaC20H15FN4
Molecular Weight330.37 g/mol
Exact Mass330.13
IUPAC Name6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine
SMILESFc1cccc(-c2cc3ccnc(NCc4cccnc4)c3cn2)c1
InChIInChI=1S/C20H15FN4/c21-17-5-1-4-16(9-17)19-10-15-6-8-23-20(18(15)13-24-19)25-12-14-3-2-7-22-11-14/h1-11,13H,12H2,(H,23,25)
InChIKeyUNQGQNZSHDUOFW-UHFFFAOYSA-N
XLogP4.44
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine?
The IUPAC name of 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine (CID 175829223) is 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine.
What is the SMILES notation for 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine?
The canonical SMILES for 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine is Fc1cccc(-c2cc3ccnc(NCc4cccnc4)c3cn2)c1.
What is the InChIKey of 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine?
The InChIKey is UNQGQNZSHDUOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN4/c21-17-5-1-4-16(9-17)19-10-15-6-8-23-20(18(15)13-24-19)25-12-14-3-2-7-22-11-14/h1-11,13H,12H2,(H,23,25).
What are the key properties of 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine?
6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine has a molecular weight of 330.37 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)-N-(pyridin-3-ylmethyl)-2,7-naphthyridin-1-amine is sourced from PubChem (CID 175829223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).