2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine

C20H10F4N4 — CID 123219090

IUPAC2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine
SMILESFc1cccc(-c2cc(-c3cnc(-c4ncccc4F)c(F)c3)cc(F)n2)n1
InChIInChI=1S/C20H10F4N4/c21-13-3-2-6-25-19(13)20-14(22)7-12(10-26-20)11-8-16(28-18(24)9-11)15-4-1-5-17(23)27-15/h1-10H
InChIKeyWJYIGXLTWVDIEA-UHFFFAOYSA-N
MW382.32 g/mol
LogP4.82
Rot. Bonds3

About 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine

2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine (PubChem CID 123219090) has the molecular formula C20H10F4N4 and a molecular weight of 382.32 g/mol. Its IUPAC name is 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine.

Molecular Properties

Compound Name2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine
PubChem CID123219090
Molecular FormulaC20H10F4N4
Molecular Weight382.32 g/mol
Exact Mass382.08
IUPAC Name2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine
SMILESFc1cccc(-c2cc(-c3cnc(-c4ncccc4F)c(F)c3)cc(F)n2)n1
InChIInChI=1S/C20H10F4N4/c21-13-3-2-6-25-19(13)20-14(22)7-12(10-26-20)11-8-16(28-18(24)9-11)15-4-1-5-17(23)27-15/h1-10H
InChIKeyWJYIGXLTWVDIEA-UHFFFAOYSA-N
XLogP4.82
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.32
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5,5'-Dimethyl-2,2'-bipyridyl
CID 15664
N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
4,4'-Dimethyl-2,2'-bipyridine
CID 14338
2,2':6',2''-Terpyridine
CID 70848
2,4'-Bipyridine
CID 68488
Anabasamine
CID 161313
2-(2-(3-Pyridinyl)ethyl)pyridine
CID 248743
4,4'-Diphenyl-2,2'-bipyridine
CID 80259
2,3,5,6-Tetrakis(2-pyridyl)pyrazine
CID 3034360
5-[4-Fluoro-3-(3-fluoropyridin-2-yl)phenyl]-3-(2-fluorophenyl)-pyridazine
CID 10384086
5-[3-(3,5-Difluoropyridin-2-yl)-4-fluorophenyl]-3-(2-fluorophenyl)pyridazine
CID 10474944
5-[4-Fluoro-3-(3-fluoropyridin-2-yl)phenyl]-3-(3-fluoropyridin-2-yl)pyridazine
CID 11530663

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine?
The IUPAC name of 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine (CID 123219090) is 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine.
What is the SMILES notation for 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine?
The canonical SMILES for 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine is Fc1cccc(-c2cc(-c3cnc(-c4ncccc4F)c(F)c3)cc(F)n2)n1.
What is the InChIKey of 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine?
The InChIKey is WJYIGXLTWVDIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10F4N4/c21-13-3-2-6-25-19(13)20-14(22)7-12(10-26-20)11-8-16(28-18(24)9-11)15-4-1-5-17(23)27-15/h1-10H.
What are the key properties of 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine?
2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine has a molecular weight of 382.32 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[5-fluoro-6-(3-fluoro-2-pyridinyl)-3-pyridinyl]-6-(6-fluoro-2-pyridinyl)pyridine is sourced from PubChem (CID 123219090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).