6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine

C23H15FN4 — CID 68913112

IUPAC6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine
SMILESNc1nc(-c2ccc3ccccc3c2)c2nc(-c3ccc(F)cc3)ccc2n1
InChIInChI=1S/C23H15FN4/c24-18-9-7-15(8-10-18)19-11-12-20-22(26-19)21(28-23(25)27-20)17-6-5-14-3-1-2-4-16(14)13-17/h1-13H,(H2,25,27,28)
InChIKeyIOYAMNQOULVYST-UHFFFAOYSA-N
MW366.40 g/mol
LogP5.23
Rot. Bonds2

About 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine

6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine (PubChem CID 68913112) has the molecular formula C23H15FN4 and a molecular weight of 366.40 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine
PubChem CID68913112
Molecular FormulaC23H15FN4
Molecular Weight366.40 g/mol
Exact Mass366.13
IUPAC Name6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine
SMILESNc1nc(-c2ccc3ccccc3c2)c2nc(-c3ccc(F)cc3)ccc2n1
InChIInChI=1S/C23H15FN4/c24-18-9-7-15(8-10-18)19-11-12-20-22(26-19)21(28-23(25)27-20)17-6-5-14-3-1-2-4-16(14)13-17/h1-13H,(H2,25,27,28)
InChIKeyIOYAMNQOULVYST-UHFFFAOYSA-N
XLogP5.23
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.40
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The IUPAC name of 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine (CID 68913112) is 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The canonical SMILES for 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine is Nc1nc(-c2ccc3ccccc3c2)c2nc(-c3ccc(F)cc3)ccc2n1.
What is the InChIKey of 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine?
The InChIKey is IOYAMNQOULVYST-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FN4/c24-18-9-7-15(8-10-18)19-11-12-20-22(26-19)21(28-23(25)27-20)17-6-5-14-3-1-2-4-16(14)13-17/h1-13H,(H2,25,27,28).
What are the key properties of 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine?
6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine has a molecular weight of 366.40 g/mol, XLogP of 5.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-4-naphthalen-2-ylpyrido[3,2-d]pyrimidin-2-amine is sourced from PubChem (CID 68913112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).