3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine

C12H7Cl2F2NO — CID 63269403

IUPAC3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine
SMILESFc1ccc(F)c(Oc2ncc(CCl)cc2Cl)c1
InChIInChI=1S/C12H7Cl2F2NO/c13-5-7-3-9(14)12(17-6-7)18-11-4-8(15)1-2-10(11)16/h1-4,6H,5H2
InChIKeyGYKJNIYNKZXZMO-UHFFFAOYSA-N
MW290.10 g/mol
LogP4.54
Rot. Bonds3

About 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine

3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine (PubChem CID 63269403) has the molecular formula C12H7Cl2F2NO and a molecular weight of 290.10 g/mol. Its IUPAC name is 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine.

Molecular Properties

Compound Name3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine
PubChem CID63269403
Molecular FormulaC12H7Cl2F2NO
Molecular Weight290.10 g/mol
Exact Mass288.99
IUPAC Name3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine
SMILESFc1ccc(F)c(Oc2ncc(CCl)cc2Cl)c1
InChIInChI=1S/C12H7Cl2F2NO/c13-5-7-3-9(14)12(17-6-7)18-11-4-8(15)1-2-10(11)16/h1-4,6H,5H2
InChIKeyGYKJNIYNKZXZMO-UHFFFAOYSA-N
XLogP4.54
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.10
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

3-chloro-5-(chloromethyl)-2-(3,4-difluorophenoxy)pyridine
CID 61269746
[5-chloro-6-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanol
CID 64855240
2-(2-tert-butylphenoxy)-3-chloro-5-(chloromethyl)pyridine
CID 63446144
N-[[5-chloro-6-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methyl]propan-2-amine
CID 64854100
5-(chloromethyl)-2-(5-chloro-2-methylphenoxy)-3-methylpyridine
CID 80628036
3,5-dichloro-6-(2,5-difluorophenoxy)pyridin-2-amine
CID 102760964
2-bromo-4-(chloromethyl)-1-(2,5-difluorophenoxy)benzene
CID 114062638
[5-chloro-6-(2,5-dichlorophenoxy)-3-pyridinyl]methanamine
CID 62296562
1-[3-chloro-4-(2,5-difluorophenoxy)phenyl]-N-methylmethanamine
CID 81155141
2-[(3,5-dichloro-2-pyridinyl)oxy]-4-fluorobenzoic acid
CID 107016480
N-[[6-(2-bromo-4-fluorophenoxy)-5-chloro-3-pyridinyl]methyl]propan-1-amine
CID 62298131
1-(2-chloro-4-fluorophenoxy)-4-(chloromethyl)isoquinoline
CID 106769449

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine?
The IUPAC name of 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine (CID 63269403) is 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine.
What is the SMILES notation for 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine?
The canonical SMILES for 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine is Fc1ccc(F)c(Oc2ncc(CCl)cc2Cl)c1.
What is the InChIKey of 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine?
The InChIKey is GYKJNIYNKZXZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2F2NO/c13-5-7-3-9(14)12(17-6-7)18-11-4-8(15)1-2-10(11)16/h1-4,6H,5H2.
What are the key properties of 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine?
3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine has a molecular weight of 290.10 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(chloromethyl)-2-(2,5-difluorophenoxy)pyridine is sourced from PubChem (CID 63269403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).