2-fluoranthen-7-yl-4-methylpyridine

C22H15N — CID 170382239

IUPAC2-fluoranthen-7-yl-4-methylpyridine
SMILESCc1ccnc(-c2cccc3c2-c2cccc4cccc-3c24)c1
InChIInChI=1S/C22H15N/c1-14-11-12-23-20(13-14)18-9-4-8-17-16-7-2-5-15-6-3-10-19(21(15)16)22(17)18/h2-13H,1H3
InChIKeyQAIZOXZZTZWCBD-UHFFFAOYSA-N
MW293.37 g/mol
LogP5.86
Rot. Bonds1

About 2-fluoranthen-7-yl-4-methylpyridine

2-fluoranthen-7-yl-4-methylpyridine (PubChem CID 170382239) has the molecular formula C22H15N and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-fluoranthen-7-yl-4-methylpyridine.

Molecular Properties

Compound Name2-fluoranthen-7-yl-4-methylpyridine
PubChem CID170382239
Molecular FormulaC22H15N
Molecular Weight293.37 g/mol
Exact Mass293.12
IUPAC Name2-fluoranthen-7-yl-4-methylpyridine
SMILESCc1ccnc(-c2cccc3c2-c2cccc4cccc-3c24)c1
InChIInChI=1S/C22H15N/c1-14-11-12-23-20(13-14)18-9-4-8-17-16-7-2-5-15-6-3-10-19(21(15)16)22(17)18/h2-13H,1H3
InChIKeyQAIZOXZZTZWCBD-UHFFFAOYSA-N
XLogP5.86
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.37
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoranthen-7-yl-4-methylpyridine?
The IUPAC name of 2-fluoranthen-7-yl-4-methylpyridine (CID 170382239) is 2-fluoranthen-7-yl-4-methylpyridine.
What is the SMILES notation for 2-fluoranthen-7-yl-4-methylpyridine?
The canonical SMILES for 2-fluoranthen-7-yl-4-methylpyridine is Cc1ccnc(-c2cccc3c2-c2cccc4cccc-3c24)c1.
What is the InChIKey of 2-fluoranthen-7-yl-4-methylpyridine?
The InChIKey is QAIZOXZZTZWCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N/c1-14-11-12-23-20(13-14)18-9-4-8-17-16-7-2-5-15-6-3-10-19(21(15)16)22(17)18/h2-13H,1H3.
What are the key properties of 2-fluoranthen-7-yl-4-methylpyridine?
2-fluoranthen-7-yl-4-methylpyridine has a molecular weight of 293.37 g/mol, XLogP of 5.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoranthen-7-yl-4-methylpyridine is sourced from PubChem (CID 170382239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).