4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine

C10H14Cl2N2O — CID 106815000

IUPAC4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine
SMILESCCOCCc1nc(Cl)c(CC)c(Cl)n1
InChIInChI=1S/C10H14Cl2N2O/c1-3-7-9(11)13-8(14-10(7)12)5-6-15-4-2/h3-6H2,1-2H3
InChIKeyHFVOYRPCLLCTPK-UHFFFAOYSA-N
MW249.14 g/mol
LogP2.92
Rot. Bonds5

About 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine

4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine (PubChem CID 106815000) has the molecular formula C10H14Cl2N2O and a molecular weight of 249.14 g/mol. Its IUPAC name is 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine.

Molecular Properties

Compound Name4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine
PubChem CID106815000
Molecular FormulaC10H14Cl2N2O
Molecular Weight249.14 g/mol
Exact Mass248.05
IUPAC Name4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine
SMILESCCOCCc1nc(Cl)c(CC)c(Cl)n1
InChIInChI=1S/C10H14Cl2N2O/c1-3-7-9(11)13-8(14-10(7)12)5-6-15-4-2/h3-6H2,1-2H3
InChIKeyHFVOYRPCLLCTPK-UHFFFAOYSA-N
XLogP2.92
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.14
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-2-(2-ethoxyethyl)-5-ethyl-6-methylpyrimidine
CID 106814990
5-bromo-4-chloro-2-(2-ethoxyethyl)-6-ethylpyrimidine
CID 106815014
4-chloro-2-(2-ethoxyethyl)-5-iodo-6-propan-2-ylpyrimidine
CID 106815017
4,6-dichloro-5-(2-chlorophenyl)-2-(2-ethoxyethyl)pyrimidine
CID 106815035
5-bromo-4-chloro-2-(2-ethoxyethyl)pyrimidine
CID 106815020
5-(2-bromophenyl)-4,6-dichloro-2-(2-ethoxyethyl)pyrimidine
CID 106815034
[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 106815543
4-chloro-6-ethyl-5-iodo-2-(2-methoxyethyl)pyrimidine
CID 66292183
4,6-dichloro-2-(1-ethoxyethyl)-5-ethylpyrimidine
CID 64539437
2-butyl-4,6-dichloro-5-propylpyrimidine
CID 79404356
4-chloro-2-[2-(2-methoxyethoxy)ethyl]-5,6-dimethylpyrimidine
CID 102927201
5-bromo-6-tert-butyl-2-(2-ethoxyethyl)pyrimidin-4-amine
CID 106815293

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine?
The IUPAC name of 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine (CID 106815000) is 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine.
What is the SMILES notation for 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine?
The canonical SMILES for 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine is CCOCCc1nc(Cl)c(CC)c(Cl)n1.
What is the InChIKey of 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine?
The InChIKey is HFVOYRPCLLCTPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14Cl2N2O/c1-3-7-9(11)13-8(14-10(7)12)5-6-15-4-2/h3-6H2,1-2H3.
What are the key properties of 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine?
4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine has a molecular weight of 249.14 g/mol, XLogP of 2.92, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine is sourced from PubChem (CID 106815000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).