2,4-dichloro-6-(furan-3-yl)pyrimidine

C8H4Cl2N2O — CID 10488849

IUPAC2,4-dichloro-6-(furan-3-yl)pyrimidine
SMILESClc1cc(-c2ccoc2)nc(Cl)n1
InChIInChI=1S/C8H4Cl2N2O/c9-7-3-6(11-8(10)12-7)5-1-2-13-4-5/h1-4H
InChIKeyRLBRVDMYFVIMDK-UHFFFAOYSA-N
MW215.04 g/mol
LogP3.04
Rot. Bonds1

About 2,4-dichloro-6-(furan-3-yl)pyrimidine

2,4-dichloro-6-(furan-3-yl)pyrimidine (PubChem CID 10488849) has the molecular formula C8H4Cl2N2O and a molecular weight of 215.04 g/mol. Its IUPAC name is 2,4-dichloro-6-(furan-3-yl)pyrimidine.

Molecular Properties

Compound Name2,4-dichloro-6-(furan-3-yl)pyrimidine
PubChem CID10488849
Molecular FormulaC8H4Cl2N2O
Molecular Weight215.04 g/mol
Exact Mass213.97
IUPAC Name2,4-dichloro-6-(furan-3-yl)pyrimidine
SMILESClc1cc(-c2ccoc2)nc(Cl)n1
InChIInChI=1S/C8H4Cl2N2O/c9-7-3-6(11-8(10)12-7)5-1-2-13-4-5/h1-4H
InChIKeyRLBRVDMYFVIMDK-UHFFFAOYSA-N
XLogP3.04
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.04
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,4-dichloro-6-(furan-3-yl)pyrimidine 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-6-(furan-3-yl)pyrimidine?
The IUPAC name of 2,4-dichloro-6-(furan-3-yl)pyrimidine (CID 10488849) is 2,4-dichloro-6-(furan-3-yl)pyrimidine.
What is the SMILES notation for 2,4-dichloro-6-(furan-3-yl)pyrimidine?
The canonical SMILES for 2,4-dichloro-6-(furan-3-yl)pyrimidine is Clc1cc(-c2ccoc2)nc(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-(furan-3-yl)pyrimidine?
The InChIKey is RLBRVDMYFVIMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2N2O/c9-7-3-6(11-8(10)12-7)5-1-2-13-4-5/h1-4H.
What are the key properties of 2,4-dichloro-6-(furan-3-yl)pyrimidine?
2,4-dichloro-6-(furan-3-yl)pyrimidine has a molecular weight of 215.04 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(furan-3-yl)pyrimidine is sourced from PubChem (CID 10488849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).