2,4-dichloro-5,6-diethylpyrimidine

C8H10Cl2N2 — CID 22951070

IUPAC2,4-dichloro-5,6-diethylpyrimidine
SMILESCCc1nc(Cl)nc(Cl)c1CC
InChIInChI=1S/C8H10Cl2N2/c1-3-5-6(4-2)11-8(10)12-7(5)9/h3-4H2,1-2H3
InChIKeyLZOCIWXSTVWIFG-UHFFFAOYSA-N
MW205.09 g/mol
LogP2.91
Rot. Bonds2

About 2,4-dichloro-5,6-diethylpyrimidine

2,4-dichloro-5,6-diethylpyrimidine (PubChem CID 22951070) has the molecular formula C8H10Cl2N2 and a molecular weight of 205.09 g/mol. Its IUPAC name is 2,4-dichloro-5,6-diethylpyrimidine.

Molecular Properties

Compound Name2,4-dichloro-5,6-diethylpyrimidine
PubChem CID22951070
Molecular FormulaC8H10Cl2N2
Molecular Weight205.09 g/mol
Exact Mass204.02
IUPAC Name2,4-dichloro-5,6-diethylpyrimidine
SMILESCCc1nc(Cl)nc(Cl)c1CC
InChIInChI=1S/C8H10Cl2N2/c1-3-5-6(4-2)11-8(10)12-7(5)9/h3-4H2,1-2H3
InChIKeyLZOCIWXSTVWIFG-UHFFFAOYSA-N
XLogP2.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.09
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-dichloro-5,6-diethylpyrimidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5,6-diethylpyrimidine?
The IUPAC name of 2,4-dichloro-5,6-diethylpyrimidine (CID 22951070) is 2,4-dichloro-5,6-diethylpyrimidine.
What is the SMILES notation for 2,4-dichloro-5,6-diethylpyrimidine?
The canonical SMILES for 2,4-dichloro-5,6-diethylpyrimidine is CCc1nc(Cl)nc(Cl)c1CC.
What is the InChIKey of 2,4-dichloro-5,6-diethylpyrimidine?
The InChIKey is LZOCIWXSTVWIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10Cl2N2/c1-3-5-6(4-2)11-8(10)12-7(5)9/h3-4H2,1-2H3.
What are the key properties of 2,4-dichloro-5,6-diethylpyrimidine?
2,4-dichloro-5,6-diethylpyrimidine has a molecular weight of 205.09 g/mol, XLogP of 2.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5,6-diethylpyrimidine is sourced from PubChem (CID 22951070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).