2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine

C9H14BrN3 — CID 83852748

IUPAC2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine
SMILESCC(C)c1nc(Br)cc(CCN)n1
InChIInChI=1S/C9H14BrN3/c1-6(2)9-12-7(3-4-11)5-8(10)13-9/h5-6H,3-4,11H2,1-2H3
InChIKeyREOZDXKEEUHIGZ-UHFFFAOYSA-N
MW244.14 g/mol
LogP1.86
Rot. Bonds3

About 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine

2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine (PubChem CID 83852748) has the molecular formula C9H14BrN3 and a molecular weight of 244.14 g/mol. Its IUPAC name is 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine
PubChem CID83852748
Molecular FormulaC9H14BrN3
Molecular Weight244.14 g/mol
Exact Mass243.04
IUPAC Name2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine
SMILESCC(C)c1nc(Br)cc(CCN)n1
InChIInChI=1S/C9H14BrN3/c1-6(2)9-12-7(3-4-11)5-8(10)13-9/h5-6H,3-4,11H2,1-2H3
InChIKeyREOZDXKEEUHIGZ-UHFFFAOYSA-N
XLogP1.86
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.14
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-6-propan-2-ylpyrimidin-4-yl)ethanamine
CID 83852742
3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine
CID 83884578
4-bromo-6-methyl-2-propan-2-ylpyrimidine
CID 43517260
4-bromo-6-(4-chlorophenyl)-2-propan-2-ylpyrimidine
CID 112554781
(6-methoxy-2-propan-2-ylpyrimidin-4-yl)methanamine
CID 83851901
6-bromo-2-propan-2-yl-N-prop-2-enylpyrimidin-4-amine
CID 106194655
2-[2-(1-ethoxy-2-methylpropyl)-6-methylpyrimidin-4-yl]ethanamine
CID 116731486
4-bromo-2-propan-2-yl-6-(3-propylphenyl)pyrimidine
CID 116545990
N-ethyl-2-propan-2-yl-6-propylpyrimidin-4-amine
CID 62192677
2-(6-propan-2-yl-2-pyridinyl)ethanamine
CID 20823809
4-(2-aminoethyl)-6-methoxypyrimidin-2-amine
CID 83851816
4-bromo-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidine
CID 112554790

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine?
The IUPAC name of 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine (CID 83852748) is 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine.
What is the SMILES notation for 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine?
The canonical SMILES for 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine is CC(C)c1nc(Br)cc(CCN)n1.
What is the InChIKey of 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine?
The InChIKey is REOZDXKEEUHIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14BrN3/c1-6(2)9-12-7(3-4-11)5-8(10)13-9/h5-6H,3-4,11H2,1-2H3.
What are the key properties of 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine?
2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine has a molecular weight of 244.14 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine is sourced from PubChem (CID 83852748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).