4,6-dichloro-5-(4-fluorophenyl)pyrimidine

C10H5Cl2FN2 — CID 19735516

IUPAC4,6-dichloro-5-(4-fluorophenyl)pyrimidine
SMILESFc1ccc(-c2c(Cl)ncnc2Cl)cc1
InChIInChI=1S/C10H5Cl2FN2/c11-9-8(10(12)15-5-14-9)6-1-3-7(13)4-2-6/h1-5H
InChIKeyAEPMVNQSCZIHES-UHFFFAOYSA-N
MW243.07 g/mol
LogP3.59
Rot. Bonds1

About 4,6-dichloro-5-(4-fluorophenyl)pyrimidine

4,6-dichloro-5-(4-fluorophenyl)pyrimidine (PubChem CID 19735516) has the molecular formula C10H5Cl2FN2 and a molecular weight of 243.07 g/mol. Its IUPAC name is 4,6-dichloro-5-(4-fluorophenyl)pyrimidine.

Molecular Properties

Compound Name4,6-dichloro-5-(4-fluorophenyl)pyrimidine
PubChem CID19735516
Molecular FormulaC10H5Cl2FN2
Molecular Weight243.07 g/mol
Exact Mass241.98
IUPAC Name4,6-dichloro-5-(4-fluorophenyl)pyrimidine
SMILESFc1ccc(-c2c(Cl)ncnc2Cl)cc1
InChIInChI=1S/C10H5Cl2FN2/c11-9-8(10(12)15-5-14-9)6-1-3-7(13)4-2-6/h1-5H
InChIKeyAEPMVNQSCZIHES-UHFFFAOYSA-N
XLogP3.59
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.07
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-3-(4-fluorophenyl)pyridine-4-carbaldehyde
CID 119011703
4,6-dichloro-2-ethyl-5-(4-fluorophenyl)pyrimidine
CID 79437703
4,6-dichloro-5-(4-fluorophenyl)-2-pyridin-2-ylpyrimidine
CID 79431898
4,6-dichloro-5-thiophen-3-ylpyrimidine
CID 138643167
4-chloro-3-(4-fluorophenyl)pyridin-2-amine
CID 119054060
4,6-dichloro-5-(4-fluorophenyl)-N-phenylpyrimidin-2-amine
CID 86045434
4,6-dichloro-5-(4-fluorophenyl)-2-thiophen-3-ylpyrimidine
CID 79438292
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
6-chloro-N-(4-fluorophenyl)-5-methylpyrimidin-4-amine
CID 63735765
3,5-dichloro-4-(4-fluorophenyl)aniline
CID 89422733
1-chloro-3-fluoro-2-(4-fluorophenyl)benzene
CID 57094846
2-(4-bromothiophen-2-yl)-4,6-dichloro-5-(4-fluorophenyl)pyrimidine
CID 79431886

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-5-(4-fluorophenyl)pyrimidine?
The IUPAC name of 4,6-dichloro-5-(4-fluorophenyl)pyrimidine (CID 19735516) is 4,6-dichloro-5-(4-fluorophenyl)pyrimidine.
What is the SMILES notation for 4,6-dichloro-5-(4-fluorophenyl)pyrimidine?
The canonical SMILES for 4,6-dichloro-5-(4-fluorophenyl)pyrimidine is Fc1ccc(-c2c(Cl)ncnc2Cl)cc1.
What is the InChIKey of 4,6-dichloro-5-(4-fluorophenyl)pyrimidine?
The InChIKey is AEPMVNQSCZIHES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2FN2/c11-9-8(10(12)15-5-14-9)6-1-3-7(13)4-2-6/h1-5H.
What are the key properties of 4,6-dichloro-5-(4-fluorophenyl)pyrimidine?
4,6-dichloro-5-(4-fluorophenyl)pyrimidine has a molecular weight of 243.07 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-5-(4-fluorophenyl)pyrimidine is sourced from PubChem (CID 19735516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).