4-(2,3-dichlorophenoxy)-6-fluoropyrimidine

C10H5Cl2FN2O — CID 115416122

IUPAC4-(2,3-dichlorophenoxy)-6-fluoropyrimidine
SMILESFc1cc(Oc2cccc(Cl)c2Cl)ncn1
InChIInChI=1S/C10H5Cl2FN2O/c11-6-2-1-3-7(10(6)12)16-9-4-8(13)14-5-15-9/h1-5H
InChIKeyBMZFJQNVBNATLJ-UHFFFAOYSA-N
MW259.07 g/mol
LogP3.71
Rot. Bonds2

About 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine

4-(2,3-dichlorophenoxy)-6-fluoropyrimidine (PubChem CID 115416122) has the molecular formula C10H5Cl2FN2O and a molecular weight of 259.07 g/mol. Its IUPAC name is 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine.

Molecular Properties

Compound Name4-(2,3-dichlorophenoxy)-6-fluoropyrimidine
PubChem CID115416122
Molecular FormulaC10H5Cl2FN2O
Molecular Weight259.07 g/mol
Exact Mass257.98
IUPAC Name4-(2,3-dichlorophenoxy)-6-fluoropyrimidine
SMILESFc1cc(Oc2cccc(Cl)c2Cl)ncn1
InChIInChI=1S/C10H5Cl2FN2O/c11-6-2-1-3-7(10(6)12)16-9-4-8(13)14-5-15-9/h1-5H
InChIKeyBMZFJQNVBNATLJ-UHFFFAOYSA-N
XLogP3.71
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.07
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-6-(3-fluorophenoxy)pyrimidine
CID 115416111
4-(2,3-dichlorophenoxy)triazine
CID 19834440
6-(2-chlorophenoxy)pyrimidin-4-amine
CID 80863719
1,2-dichloro-3-(2,6-dichlorophenoxy)benzene
CID 72941859
1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62297929
4-chloro-6-(2,3-dichlorophenoxy)-2-methylsulfanylpyrimidine
CID 113221056
4-(2,3-dichlorophenoxy)-2-methylsulfanylpyridine
CID 173291560
N-(2,3-dichlorophenyl)-6-fluoropyrimidin-4-amine
CID 115416269
1-[6-(2,3-dichlorophenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62296347
[3-(6-fluoropyrimidin-4-yl)oxyphenyl]methanol
CID 115416170
6-(2,3-dichlorophenoxy)pyridine-2,3-diamine
CID 79826072
N-[[2-(2,3-dichlorophenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62298107

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine?
The IUPAC name of 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine (CID 115416122) is 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine.
What is the SMILES notation for 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine?
The canonical SMILES for 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine is Fc1cc(Oc2cccc(Cl)c2Cl)ncn1.
What is the InChIKey of 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine?
The InChIKey is BMZFJQNVBNATLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2FN2O/c11-6-2-1-3-7(10(6)12)16-9-4-8(13)14-5-15-9/h1-5H.
What are the key properties of 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine?
4-(2,3-dichlorophenoxy)-6-fluoropyrimidine has a molecular weight of 259.07 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dichlorophenoxy)-6-fluoropyrimidine is sourced from PubChem (CID 115416122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).