5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine

C10H14BrN3 — CID 107925692

IUPAC5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine
SMILESCc1nc(C2CC2(C)C)nc(N)c1Br
InChIInChI=1S/C10H14BrN3/c1-5-7(11)8(12)14-9(13-5)6-4-10(6,2)3/h6H,4H2,1-3H3,(H2,12,13,14)
InChIKeyHQYMBYJOSUJTJR-UHFFFAOYSA-N
MW256.15 g/mol
LogP2.64
Rot. Bonds1

About 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine

5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine (PubChem CID 107925692) has the molecular formula C10H14BrN3 and a molecular weight of 256.15 g/mol. Its IUPAC name is 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine
PubChem CID107925692
Molecular FormulaC10H14BrN3
Molecular Weight256.15 g/mol
Exact Mass255.04
IUPAC Name5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine
SMILESCc1nc(C2CC2(C)C)nc(N)c1Br
InChIInChI=1S/C10H14BrN3/c1-5-7(11)8(12)14-9(13-5)6-4-10(6,2)3/h6H,4H2,1-3H3,(H2,12,13,14)
InChIKeyHQYMBYJOSUJTJR-UHFFFAOYSA-N
XLogP2.64
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine (CID 107925692) is 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine is Cc1nc(C2CC2(C)C)nc(N)c1Br.
What is the InChIKey of 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine?
The InChIKey is HQYMBYJOSUJTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3/c1-5-7(11)8(12)14-9(13-5)6-4-10(6,2)3/h6H,4H2,1-3H3,(H2,12,13,14).
What are the key properties of 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine?
5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine has a molecular weight of 256.15 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2,2-dimethylcyclopropyl)-6-methylpyrimidin-4-amine is sourced from PubChem (CID 107925692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).