5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine

C10H14BrClN2O — CID 106815014

IUPAC5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine
SMILESCCOCCc1nc(Cl)c(Br)c(CC)n1
InChIInChI=1S/C10H14BrClN2O/c1-3-7-9(11)10(12)14-8(13-7)5-6-15-4-2/h3-6H2,1-2H3
InChIKeyDLFQPHPZGSSZLD-UHFFFAOYSA-N
MW293.59 g/mol
LogP3.03
Rot. Bonds5

About 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine

5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine (PubChem CID 106815014) has the molecular formula C10H14BrClN2O and a molecular weight of 293.59 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine.

Molecular Properties

Compound Name5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine
PubChem CID106815014
Molecular FormulaC10H14BrClN2O
Molecular Weight293.59 g/mol
Exact Mass292.00
IUPAC Name5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine
SMILESCCOCCc1nc(Cl)c(Br)c(CC)n1
InChIInChI=1S/C10H14BrClN2O/c1-3-7-9(11)10(12)14-8(13-7)5-6-15-4-2/h3-6H2,1-2H3
InChIKeyDLFQPHPZGSSZLD-UHFFFAOYSA-N
XLogP3.03
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.59
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine
CID 106815000
5-bromo-4-chloro-6-propyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidine
CID 103146715
4-chloro-2-(2-ethoxyethyl)-5-ethyl-6-methylpyrimidine
CID 106814990
5-(2-bromophenyl)-4,6-dichloro-2-(2-ethoxyethyl)pyrimidine
CID 106815034
5-bromo-4-chloro-2-(2-ethoxyethyl)pyrimidine
CID 106815020
4,6-dichloro-5-(2-chlorophenyl)-2-(2-ethoxyethyl)pyrimidine
CID 106815035
5-bromo-4-chloro-6-(methoxymethyl)-2-(3-methoxypropyl)pyrimidine
CID 66293231
5-bromo-2-(butan-2-ylsulfanylmethyl)-4-chloro-6-ethylpyrimidine
CID 66293395
4-chloro-2-(2-ethoxyethyl)-5-iodo-6-propan-2-ylpyrimidine
CID 106815017
4-chloro-6-ethyl-5-iodo-2-(2-methoxyethyl)pyrimidine
CID 66292183
5-bromo-4-chloro-2-[(2-chlorophenyl)methyl]-6-ethylpyrimidine
CID 66292376
5-bromo-4-chloro-2-(cyclopentylsulfanylmethyl)-6-ethylpyrimidine
CID 66294627

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine?
The IUPAC name of 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine (CID 106815014) is 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine.
What is the SMILES notation for 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine?
The canonical SMILES for 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine is CCOCCc1nc(Cl)c(Br)c(CC)n1.
What is the InChIKey of 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine?
The InChIKey is DLFQPHPZGSSZLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrClN2O/c1-3-7-9(11)10(12)14-8(13-7)5-6-15-4-2/h3-6H2,1-2H3.
What are the key properties of 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine?
5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine has a molecular weight of 293.59 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine is sourced from PubChem (CID 106815014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).