5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine

C11H13BrCl2N2 — CID 66314551

IUPAC5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine
SMILESCCC1CCC(c2nc(Cl)c(Br)c(Cl)n2)C1
InChIInChI=1S/C11H13BrCl2N2/c1-2-6-3-4-7(5-6)11-15-9(13)8(12)10(14)16-11/h6-7H,2-5H2,1H3
InChIKeyFEZSRLYRFBTISH-UHFFFAOYSA-N
MW324.05 g/mol
LogP4.84
Rot. Bonds2

About 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine

5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine (PubChem CID 66314551) has the molecular formula C11H13BrCl2N2 and a molecular weight of 324.05 g/mol. Its IUPAC name is 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine.

Molecular Properties

Compound Name5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine
PubChem CID66314551
Molecular FormulaC11H13BrCl2N2
Molecular Weight324.05 g/mol
Exact Mass321.96
IUPAC Name5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine
SMILESCCC1CCC(c2nc(Cl)c(Br)c(Cl)n2)C1
InChIInChI=1S/C11H13BrCl2N2/c1-2-6-3-4-7(5-6)11-15-9(13)8(12)10(14)16-11/h6-7H,2-5H2,1H3
InChIKeyFEZSRLYRFBTISH-UHFFFAOYSA-N
XLogP4.84
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.05
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-4-chloro-6-ethyl-2-(4-ethylcyclohexyl)pyrimidine
CID 66294833
5-bromo-4-tert-butyl-6-chloro-2-(3-ethylcyclohexyl)pyrimidine
CID 66294812
5-bromo-4-chloro-2-cyclopropyl-6-propylpyrimidine
CID 66293970
4-chloro-2-(4-ethylcyclohexyl)-5,6-dimethylpyrimidine
CID 65393714
4-cyclopentyl-6-(3-ethylcyclopentyl)-1,3,5-triazin-2-amine
CID 65404534
5-bromo-4,6-dichloro-2-cyclohexylpyrimidine
CID 66317033
5-bromo-4,6-dichloro-2-cyclooctylpyrimidine
CID 80602161
4-chloro-2-(3-ethylcyclohexyl)-5-iodo-6-propylpyrimidine
CID 66293573
5-bromo-2-(3-ethylcyclopentyl)pyrimidin-4-amine
CID 66303455
5-bromo-4-chloro-2-cyclobutyl-6-ethylpyrimidine
CID 66292583
5-ethenyl-3-(3-ethylcyclopentyl)-1,2,4-oxadiazole
CID 65413474
5-bromo-4-chloro-2-cyclohexyl-6-propylpyrimidine
CID 66292539

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine?
The IUPAC name of 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine (CID 66314551) is 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine.
What is the SMILES notation for 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine?
The canonical SMILES for 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine is CCC1CCC(c2nc(Cl)c(Br)c(Cl)n2)C1.
What is the InChIKey of 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine?
The InChIKey is FEZSRLYRFBTISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrCl2N2/c1-2-6-3-4-7(5-6)11-15-9(13)8(12)10(14)16-11/h6-7H,2-5H2,1H3.
What are the key properties of 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine?
5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine has a molecular weight of 324.05 g/mol, XLogP of 4.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4,6-dichloro-2-(3-ethylcyclopentyl)pyrimidine is sourced from PubChem (CID 66314551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).