2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine

C36H26N2O2 — CID 20753203

IUPAC2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine
SMILESCc1cccc(Oc2ccc(C3(c4ccc(Oc5ccccn5)cc4)c4ccccc4-c4ccccc43)cc2)n1
InChIInChI=1S/C36H26N2O2/c1-25-9-8-15-35(38-25)40-29-22-18-27(19-23-29)36(26-16-20-28(21-17-26)39-34-14-6-7-24-37-34)32-12-4-2-10-30(32)31-11-3-5-13-33(31)36/h2-24H,1H3
InChIKeyHWHQZYJDYZVJRU-UHFFFAOYSA-N
MW518.62 g/mol
LogP8.73
Rot. Bonds6

About 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine

2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine (PubChem CID 20753203) has the molecular formula C36H26N2O2 and a molecular weight of 518.62 g/mol. Its IUPAC name is 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine.

Molecular Properties

Compound Name2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine
PubChem CID20753203
Molecular FormulaC36H26N2O2
Molecular Weight518.62 g/mol
Exact Mass518.20
IUPAC Name2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine
SMILESCc1cccc(Oc2ccc(C3(c4ccc(Oc5ccccn5)cc4)c4ccccc4-c4ccccc43)cc2)n1
InChIInChI=1S/C36H26N2O2/c1-25-9-8-15-35(38-25)40-29-22-18-27(19-23-29)36(26-16-20-28(21-17-26)39-34-14-6-7-24-37-34)32-12-4-2-10-30(32)31-11-3-5-13-33(31)36/h2-24H,1H3
InChIKeyHWHQZYJDYZVJRU-UHFFFAOYSA-N
XLogP8.73
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.62
LogP ≤ 58.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine?
The IUPAC name of 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine (CID 20753203) is 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine.
What is the SMILES notation for 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine?
The canonical SMILES for 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine is Cc1cccc(Oc2ccc(C3(c4ccc(Oc5ccccn5)cc4)c4ccccc4-c4ccccc43)cc2)n1.
What is the InChIKey of 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine?
The InChIKey is HWHQZYJDYZVJRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N2O2/c1-25-9-8-15-35(38-25)40-29-22-18-27(19-23-29)36(26-16-20-28(21-17-26)39-34-14-6-7-24-37-34)32-12-4-2-10-30(32)31-11-3-5-13-33(31)36/h2-24H,1H3.
What are the key properties of 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine?
2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine has a molecular weight of 518.62 g/mol, XLogP of 8.73, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-[9-(4-pyridin-2-yloxyphenyl)fluoren-9-yl]phenoxy]pyridine is sourced from PubChem (CID 20753203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).