2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine

C11H5ClF3N — CID 119022782

IUPAC2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine
SMILESFc1cccc(-c2ccnc(Cl)c2F)c1F
InChIInChI=1S/C11H5ClF3N/c12-11-10(15)7(4-5-16-11)6-2-1-3-8(13)9(6)14/h1-5H
InChIKeyIYOZKYXADQIKBL-UHFFFAOYSA-N
MW243.62 g/mol
LogP3.82
Rot. Bonds1

About 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine

2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine (PubChem CID 119022782) has the molecular formula C11H5ClF3N and a molecular weight of 243.62 g/mol. Its IUPAC name is 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine.

Molecular Properties

Compound Name2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine
PubChem CID119022782
Molecular FormulaC11H5ClF3N
Molecular Weight243.62 g/mol
Exact Mass243.01
IUPAC Name2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine
SMILESFc1cccc(-c2ccnc(Cl)c2F)c1F
InChIInChI=1S/C11H5ClF3N/c12-11-10(15)7(4-5-16-11)6-2-1-3-8(13)9(6)14/h1-5H
InChIKeyIYOZKYXADQIKBL-UHFFFAOYSA-N
XLogP3.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.62
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine?
The IUPAC name of 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine (CID 119022782) is 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine.
What is the SMILES notation for 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine?
The canonical SMILES for 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine is Fc1cccc(-c2ccnc(Cl)c2F)c1F.
What is the InChIKey of 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine?
The InChIKey is IYOZKYXADQIKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5ClF3N/c12-11-10(15)7(4-5-16-11)6-2-1-3-8(13)9(6)14/h1-5H.
What are the key properties of 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine?
2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine has a molecular weight of 243.62 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(2,3-difluorophenyl)-3-fluoropyridine is sourced from PubChem (CID 119022782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).