5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine

C11H16BrN3 — CID 66303455

IUPAC5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine
SMILESCCC1CCC(c2ncc(Br)c(N)n2)C1
InChIInChI=1S/C11H16BrN3/c1-2-7-3-4-8(5-7)11-14-6-9(12)10(13)15-11/h6-8H,2-5H2,1H3,(H2,13,14,15)
InChIKeyGRFUWJSCWMMWKX-UHFFFAOYSA-N
MW270.17 g/mol
LogP3.12
Rot. Bonds2

About 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine

5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine (PubChem CID 66303455) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine
PubChem CID66303455
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine
SMILESCCC1CCC(c2ncc(Br)c(N)n2)C1
InChIInChI=1S/C11H16BrN3/c1-2-7-3-4-8(5-7)11-14-6-9(12)10(13)15-11/h6-8H,2-5H2,1H3,(H2,13,14,15)
InChIKeyGRFUWJSCWMMWKX-UHFFFAOYSA-N
XLogP3.12
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-cyclooctylpyrimidin-4-amine
CID 80610598
5-bromo-2-(4,4-dimethylcyclohexyl)pyrimidin-4-amine
CID 66303875
4-amino-2-(3-ethylcyclohexyl)pyrimidine-5-carbonitrile
CID 65413263
5-bromo-2-cyclopropyl-4-ethylpyrimidine
CID 82374760
5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine
CID 66314551
2-(3-ethylcyclopentyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 65405405
4-cyclopentyl-6-(3-ethylcyclopentyl)-1,3,5-triazin-2-amine
CID 65404534
2-[2-(3-ethylcyclopentyl)pyrimidin-4-yl]ethanamine
CID 65403501
6-cyclopropyl-2-(3-ethylcyclohexyl)-5-iodopyrimidin-4-amine
CID 66304402
ethyl 4-amino-2-(3-ethylcyclopentyl)-6-methylpyrimidine-5-carboxylate
CID 116647833
(4-amino-2-cyclopropylpyrimidin-5-yl)-(3-ethylazetidin-1-yl)methanone
CID 136547615
4-(4-ethylcyclohexyl)-1,3,5-triazin-2-amine
CID 65390155

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine (CID 66303455) is 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine is CCC1CCC(c2ncc(Br)c(N)n2)C1.
What is the InChIKey of 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine?
The InChIKey is GRFUWJSCWMMWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-2-7-3-4-8(5-7)11-14-6-9(12)10(13)15-11/h6-8H,2-5H2,1H3,(H2,13,14,15).
What are the key properties of 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine?
5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine has a molecular weight of 270.17 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine is sourced from PubChem (CID 66303455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).