4-(2-fluorophenyl)pyrimidin-2-amine

C10H8FN3 — CID 18767991

IUPAC4-(2-fluorophenyl)pyrimidin-2-amine
SMILESNc1nccc(-c2ccccc2F)n1
InChIInChI=1S/C10H8FN3/c11-8-4-2-1-3-7(8)9-5-6-13-10(12)14-9/h1-6H,(H2,12,13,14)
InChIKeyVGTHLZPUUDXDSE-UHFFFAOYSA-N
MW189.19 g/mol
LogP1.86
Rot. Bonds1

About 4-(2-fluorophenyl)pyrimidin-2-amine

4-(2-fluorophenyl)pyrimidin-2-amine (PubChem CID 18767991) has the molecular formula C10H8FN3 and a molecular weight of 189.19 g/mol. Its IUPAC name is 4-(2-fluorophenyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-fluorophenyl)pyrimidin-2-amine
PubChem CID18767991
Molecular FormulaC10H8FN3
Molecular Weight189.19 g/mol
Exact Mass189.07
IUPAC Name4-(2-fluorophenyl)pyrimidin-2-amine
SMILESNc1nccc(-c2ccccc2F)n1
InChIInChI=1S/C10H8FN3/c11-8-4-2-1-3-7(8)9-5-6-13-10(12)14-9/h1-6H,(H2,12,13,14)
InChIKeyVGTHLZPUUDXDSE-UHFFFAOYSA-N
XLogP1.86
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.19
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)pyrimidin-2-amine?
The IUPAC name of 4-(2-fluorophenyl)pyrimidin-2-amine (CID 18767991) is 4-(2-fluorophenyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(2-fluorophenyl)pyrimidin-2-amine?
The canonical SMILES for 4-(2-fluorophenyl)pyrimidin-2-amine is Nc1nccc(-c2ccccc2F)n1.
What is the InChIKey of 4-(2-fluorophenyl)pyrimidin-2-amine?
The InChIKey is VGTHLZPUUDXDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3/c11-8-4-2-1-3-7(8)9-5-6-13-10(12)14-9/h1-6H,(H2,12,13,14).
What are the key properties of 4-(2-fluorophenyl)pyrimidin-2-amine?
4-(2-fluorophenyl)pyrimidin-2-amine has a molecular weight of 189.19 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)pyrimidin-2-amine is sourced from PubChem (CID 18767991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).