4-(2-aminophenoxy)pyrimidin-2-amine

C10H10N4O — CID 133059481

IUPAC4-(2-aminophenoxy)pyrimidin-2-amine
SMILESNc1nccc(Oc2ccccc2N)n1
InChIInChI=1S/C10H10N4O/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H,11H2,(H2,12,13,14)
InChIKeyISNKUBOJBLRXLY-UHFFFAOYSA-N
MW202.22 g/mol
LogP1.43
Rot. Bonds2

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

4-(2-aminophenoxy)pyrimidin-2-amine (PubChem CID 133059481) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 4-(2-aminophenoxy)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-aminophenoxy)pyrimidin-2-amine
PubChem CID133059481
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name4-(2-aminophenoxy)pyrimidin-2-amine
SMILESNc1nccc(Oc2ccccc2N)n1
InChIInChI=1S/C10H10N4O/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H,11H2,(H2,12,13,14)
InChIKeyISNKUBOJBLRXLY-UHFFFAOYSA-N
XLogP1.43
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminophenoxy)pyrimidin-2-amine?
The IUPAC name of 4-(2-aminophenoxy)pyrimidin-2-amine (CID 133059481) is 4-(2-aminophenoxy)pyrimidin-2-amine.
What is the SMILES notation for 4-(2-aminophenoxy)pyrimidin-2-amine?
The canonical SMILES for 4-(2-aminophenoxy)pyrimidin-2-amine is Nc1nccc(Oc2ccccc2N)n1.
What is the InChIKey of 4-(2-aminophenoxy)pyrimidin-2-amine?
The InChIKey is ISNKUBOJBLRXLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c11-7-3-1-2-4-8(7)15-9-5-6-13-10(12)14-9/h1-6H,11H2,(H2,12,13,14).
What are the key properties of 4-(2-aminophenoxy)pyrimidin-2-amine?
4-(2-aminophenoxy)pyrimidin-2-amine has a molecular weight of 202.22 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminophenoxy)pyrimidin-2-amine is sourced from PubChem (CID 133059481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).