4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine

C10H8ClFN2O — CID 104789158

IUPAC4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine
SMILESCc1nc(-c2ccoc2C)nc(Cl)c1F
InChIInChI=1S/C10H8ClFN2O/c1-5-8(12)9(11)14-10(13-5)7-3-4-15-6(7)2/h3-4H,1-2H3
InChIKeyRANDHSXPUCVWMY-UHFFFAOYSA-N
MW226.64 g/mol
LogP3.15
Rot. Bonds1

About 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine

4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine (PubChem CID 104789158) has the molecular formula C10H8ClFN2O and a molecular weight of 226.64 g/mol. Its IUPAC name is 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine.

Molecular Properties

Compound Name4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine
PubChem CID104789158
Molecular FormulaC10H8ClFN2O
Molecular Weight226.64 g/mol
Exact Mass226.03
IUPAC Name4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine
SMILESCc1nc(-c2ccoc2C)nc(Cl)c1F
InChIInChI=1S/C10H8ClFN2O/c1-5-8(12)9(11)14-10(13-5)7-3-4-15-6(7)2/h3-4H,1-2H3
InChIKeyRANDHSXPUCVWMY-UHFFFAOYSA-N
XLogP3.15
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.64
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-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

Related Compounds

4-Chloro-6-ethyl-2-(furan-3-yl)pyrimidine
CID 63204889
2,4-Dichloro-6-(5-fluorofuran-3-yl)pyrimidine
CID 146458949
4-Fluoro-6-methoxy-2-(2-methylfuran-3-yl)-5-(trifluoromethyl)pyrimidine
CID 156317913
4-Fluoro-6-methoxy-2-(5-methylfuran-3-yl)-5-(trifluoromethyl)pyrimidine
CID 171463125
4-Chloro-2-(furan-2-yl)-6-methylpyrimidine-5-carbonitrile
CID 134822115
4-Chloro-5-fluoro-2-(furan-3-yl)-6-methylpyrimidine
CID 65998243
4-Chloro-5-fluoro-2-(furan-2-yl)-6-methylpyrimidine
CID 65998440
4-Chloro-5-fluoro-6-methyl-2-(5-methylfuran-2-yl)pyrimidine
CID 66000434
2-chloro-5-fluoro-N-methyl-N-[(2-methylfuran-3-yl)methyl]pyrimidin-4-amine
CID 79081350
4,6-Dichloro-5-(4-fluorophenyl)-2-(furan-3-yl)pyrimidine
CID 79437624
4,6-Dichloro-5-(2-fluorophenyl)-2-(furan-3-yl)pyrimidine
CID 79439031
4,6-Dichloro-5-(3-fluorophenyl)-2-(furan-3-yl)pyrimidine
CID 79440122

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine?
The IUPAC name of 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine (CID 104789158) is 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine.
What is the SMILES notation for 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine?
The canonical SMILES for 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine is Cc1nc(-c2ccoc2C)nc(Cl)c1F.
What is the InChIKey of 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine?
The InChIKey is RANDHSXPUCVWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2O/c1-5-8(12)9(11)14-10(13-5)7-3-4-15-6(7)2/h3-4H,1-2H3.
What are the key properties of 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine?
4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine has a molecular weight of 226.64 g/mol, XLogP of 3.15, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-fluoro-6-methyl-2-(2-methylfuran-3-yl)pyrimidine is sourced from PubChem (CID 104789158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).