6-(2-bromophenoxy)pyrimidin-4-amine

C10H8BrN3O — CID 80860684

IUPAC6-(2-bromophenoxy)pyrimidin-4-amine
SMILESNc1cc(Oc2ccccc2Br)ncn1
InChIInChI=1S/C10H8BrN3O/c11-7-3-1-2-4-8(7)15-10-5-9(12)13-6-14-10/h1-6H,(H2,12,13,14)
InChIKeySNWBIDMRFORLHK-UHFFFAOYSA-N
MW266.10 g/mol
LogP2.61
Rot. Bonds2

About 6-(2-bromophenoxy)pyrimidin-4-amine

6-(2-bromophenoxy)pyrimidin-4-amine (PubChem CID 80860684) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is 6-(2-bromophenoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-bromophenoxy)pyrimidin-4-amine
PubChem CID80860684
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name6-(2-bromophenoxy)pyrimidin-4-amine
SMILESNc1cc(Oc2ccccc2Br)ncn1
InChIInChI=1S/C10H8BrN3O/c11-7-3-1-2-4-8(7)15-10-5-9(12)13-6-14-10/h1-6H,(H2,12,13,14)
InChIKeySNWBIDMRFORLHK-UHFFFAOYSA-N
XLogP2.61
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-bromophenoxy)pyrimidin-4-amine?
The IUPAC name of 6-(2-bromophenoxy)pyrimidin-4-amine (CID 80860684) is 6-(2-bromophenoxy)pyrimidin-4-amine.
What is the SMILES notation for 6-(2-bromophenoxy)pyrimidin-4-amine?
The canonical SMILES for 6-(2-bromophenoxy)pyrimidin-4-amine is Nc1cc(Oc2ccccc2Br)ncn1.
What is the InChIKey of 6-(2-bromophenoxy)pyrimidin-4-amine?
The InChIKey is SNWBIDMRFORLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c11-7-3-1-2-4-8(7)15-10-5-9(12)13-6-14-10/h1-6H,(H2,12,13,14).
What are the key properties of 6-(2-bromophenoxy)pyrimidin-4-amine?
6-(2-bromophenoxy)pyrimidin-4-amine has a molecular weight of 266.10 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromophenoxy)pyrimidin-4-amine is sourced from PubChem (CID 80860684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).