N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine

C15H11FN4 — CID 14347109

IUPACN-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine
SMILESFc1cccc(Nc2nccc(-c3ccccn3)n2)c1
InChIInChI=1S/C15H11FN4/c16-11-4-3-5-12(10-11)19-15-18-9-7-14(20-15)13-6-1-2-8-17-13/h1-10H,(H,18,19,20)
InChIKeyJBJYVQPGNVVNDI-UHFFFAOYSA-N
MW266.28 g/mol
LogP3.42
Rot. Bonds3

About N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine

N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine (PubChem CID 14347109) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine
PubChem CID14347109
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC NameN-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine
SMILESFc1cccc(Nc2nccc(-c3ccccn3)n2)c1
InChIInChI=1S/C15H11FN4/c16-11-4-3-5-12(10-11)19-15-18-9-7-14(20-15)13-6-1-2-8-17-13/h1-10H,(H,18,19,20)
InChIKeyJBJYVQPGNVVNDI-UHFFFAOYSA-N
XLogP3.42
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine?
The IUPAC name of N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine (CID 14347109) is N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine.
What is the SMILES notation for N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine?
The canonical SMILES for N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine is Fc1cccc(Nc2nccc(-c3ccccn3)n2)c1.
What is the InChIKey of N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine?
The InChIKey is JBJYVQPGNVVNDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c16-11-4-3-5-12(10-11)19-15-18-9-7-14(20-15)13-6-1-2-8-17-13/h1-10H,(H,18,19,20).
What are the key properties of N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine?
N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine has a molecular weight of 266.28 g/mol, XLogP of 3.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-pyridin-2-ylpyrimidin-2-amine is sourced from PubChem (CID 14347109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).