2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine

C12H8FN5 — CID 146406319

IUPAC2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine
SMILESNc1nc(-c2cncc(F)c2)nc2cccnc12
InChIInChI=1S/C12H8FN5/c13-8-4-7(5-15-6-8)12-17-9-2-1-3-16-10(9)11(14)18-12/h1-6H,(H2,14,17,18)
InChIKeyRYMDKOVYERQLHU-UHFFFAOYSA-N
MW241.23 g/mol
LogP1.81
Rot. Bonds1

About 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine

2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine (PubChem CID 146406319) has the molecular formula C12H8FN5 and a molecular weight of 241.23 g/mol. Its IUPAC name is 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine
PubChem CID146406319
Molecular FormulaC12H8FN5
Molecular Weight241.23 g/mol
Exact Mass241.08
IUPAC Name2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine
SMILESNc1nc(-c2cncc(F)c2)nc2cccnc12
InChIInChI=1S/C12H8FN5/c13-8-4-7(5-15-6-8)12-17-9-2-1-3-16-10(9)11(14)18-12/h1-6H,(H2,14,17,18)
InChIKeyRYMDKOVYERQLHU-UHFFFAOYSA-N
XLogP1.81
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.23
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine?
The IUPAC name of 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine (CID 146406319) is 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine is Nc1nc(-c2cncc(F)c2)nc2cccnc12.
What is the InChIKey of 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine?
The InChIKey is RYMDKOVYERQLHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FN5/c13-8-4-7(5-15-6-8)12-17-9-2-1-3-16-10(9)11(14)18-12/h1-6H,(H2,14,17,18).
What are the key properties of 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine?
2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 241.23 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-3-pyridinyl)pyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 146406319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).