2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine

C24H19N — CID 168745083

IUPAC2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine
SMILESCC1(C)c2c(-c3ccccn3)cccc2-c2ccc3ccccc3c21
InChIInChI=1S/C24H19N/c1-24(2)22-17-9-4-3-8-16(17)13-14-19(22)18-10-7-11-20(23(18)24)21-12-5-6-15-25-21/h3-15H,1-2H3
InChIKeyZOGMZZVDQNDCBO-UHFFFAOYSA-N
MW321.42 g/mol
LogP6.21
Rot. Bonds1

About 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine

2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine (PubChem CID 168745083) has the molecular formula C24H19N and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine.

Molecular Properties

Compound Name2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine
PubChem CID168745083
Molecular FormulaC24H19N
Molecular Weight321.42 g/mol
Exact Mass321.15
IUPAC Name2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine
SMILESCC1(C)c2c(-c3ccccn3)cccc2-c2ccc3ccccc3c21
InChIInChI=1S/C24H19N/c1-24(2)22-17-9-4-3-8-16(17)13-14-19(22)18-10-7-11-20(23(18)24)21-12-5-6-15-25-21/h3-15H,1-2H3
InChIKeyZOGMZZVDQNDCBO-UHFFFAOYSA-N
XLogP6.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.42
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-hexahelicen-1-ylpyridine
CID 146019951
11,11-dimethylbenzo[a]fluorene;ethane
CID 144938734
2-(11,11-dimethyl-9H-benzo[a]fluoren-9-id-10-yl)pyridine;1,1,1,5,5,5-hexadeuteriopentane-2,4-diol;iridium
CID 168745310
2-naphthalen-1-ylpyridine;quinoxaline
CID 174357892
4-[4-(11,11-dimethylbenzo[a]fluoren-10-yl)naphthalen-1-yl]-6-phenyl-2-(4-phenylphenyl)pyrimidine
CID 168780089
12-(2,6-dipyridin-2-ylphenyl)-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 145009975
4-[4-(11,11-dimethylbenzo[a]fluoren-7-yl)phenyl]-2-phenyl-6-(4-pyridin-2-ylphenyl)pyrimidine
CID 146632009
25,25-dimethylhexacyclo[12.11.0.02,7.08,13.015,24.018,23]pentacosa-1(14),2,4,6,8,10,12,15(24),16,18,20,22-dodecaene
CID 59742066
4-[4-(11,11-dimethylbenzo[a]fluoren-10-yl)naphthalen-1-yl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 168780096
4-[4-[3-(11,11-dimethylbenzo[a]fluoren-10-yl)phenyl]naphthalen-1-yl]-2-phenyl-6-(2-phenylphenyl)pyrimidine
CID 168776629
4-[4-(11,11-dimethylbenzo[a]fluoren-10-yl)naphthalen-1-yl]-2-naphthalen-1-yl-6-(3-phenylphenyl)pyrimidine
CID 168777291
2-[4-[4-(11,11-dimethylbenzo[a]fluoren-10-yl)phenyl]naphthalen-1-yl]-4-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 168777133

Frequently Asked Questions

What is the IUPAC name of 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine?
The IUPAC name of 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine (CID 168745083) is 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine.
What is the SMILES notation for 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine?
The canonical SMILES for 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine is CC1(C)c2c(-c3ccccn3)cccc2-c2ccc3ccccc3c21.
What is the InChIKey of 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine?
The InChIKey is ZOGMZZVDQNDCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N/c1-24(2)22-17-9-4-3-8-16(17)13-14-19(22)18-10-7-11-20(23(18)24)21-12-5-6-15-25-21/h3-15H,1-2H3.
What are the key properties of 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine?
2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine has a molecular weight of 321.42 g/mol, XLogP of 6.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(11,11-dimethylbenzo[a]fluoren-10-yl)pyridine is sourced from PubChem (CID 168745083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).