2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine

C24H19N — CID 134316394

IUPAC2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine
SMILESCc1ccc2c(c1)-c1cc(C)c(-c3cccc(C)n3)c3cccc-2c13
InChIInChI=1S/C24H19N/c1-14-10-11-17-18-7-5-8-19-23(22-9-4-6-16(3)25-22)15(2)13-21(24(18)19)20(17)12-14/h4-13H,1-3H3
InChIKeyPCOMNQOBKGQCJX-UHFFFAOYSA-N
MW321.42 g/mol
LogP6.47
Rot. Bonds1

About 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine

2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine (PubChem CID 134316394) has the molecular formula C24H19N and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine.

Molecular Properties

Compound Name2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine
PubChem CID134316394
Molecular FormulaC24H19N
Molecular Weight321.42 g/mol
Exact Mass321.15
IUPAC Name2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine
SMILESCc1ccc2c(c1)-c1cc(C)c(-c3cccc(C)n3)c3cccc-2c13
InChIInChI=1S/C24H19N/c1-14-10-11-17-18-7-5-8-19-23(22-9-4-6-16(3)25-22)15(2)13-21(24(18)19)20(17)12-14/h4-13H,1-3H3
InChIKeyPCOMNQOBKGQCJX-UHFFFAOYSA-N
XLogP6.47
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 ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-3-[4-(4-phenylphenyl)phenyl]fluoranthene
CID 58995610
2-anthracen-9-yl-6-methylpyridine
CID 144659337
3,7,9-trimethylfluoranthene
CID 123365780
3-methyl-N-naphthalen-1-ylfluoren-9-imine
CID 3963334
3-(3-methylphenyl)fluoranthene
CID 123478210
1-(2,5-dimethylphenyl)perylene
CID 173065408
carbanide;hafnium;2-[2-[6-[2-(2-hydroxy-5-methylphenyl)phenyl]-2-pyridinyl]phenyl]-4-methylphenol
CID 154622877
ethane;1-methylchrysene;6-methylchrysene;3-methylfluoranthene;1-methyltriphenylene;2-methyltriphenylene
CID 158817490
4-(2,4-dimethylphenyl)-2-(6-methyl-2-pyridinyl)-1H-pyrimidin-6-one
CID 139685391
7,12-bis(2,5-dimethylphenyl)-3-phenylbenzo[k]fluoranthene
CID 123722611
4-(7,21-diphenyl-4-hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaenyl)-7,21-diphenylhexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaene;4-(7,21-diphenyl-4-hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaenyl)-7,16,18,21-tetramethylhexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaene;4-(4-hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5,7,9,11,13(24),14,16,18,20,22-dodecaenyl)-7,21-diphenylhexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaene;7,16,18,21-tetramethyl-4-(7,16,18,21-tetramethyl-4-hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaenyl)hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaene
CID 159005457
butane;3-(7,12-diphenylbenzo[k]fluoranthen-3-yl)-13-(4-methylphenyl)-4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5,7,9(16),10(15),11,13-octaene
CID 143708190

Frequently Asked Questions

What is the IUPAC name of 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine?
The IUPAC name of 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine (CID 134316394) is 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine.
What is the SMILES notation for 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine?
The canonical SMILES for 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine is Cc1ccc2c(c1)-c1cc(C)c(-c3cccc(C)n3)c3cccc-2c13.
What is the InChIKey of 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine?
The InChIKey is PCOMNQOBKGQCJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N/c1-14-10-11-17-18-7-5-8-19-23(22-9-4-6-16(3)25-22)15(2)13-21(24(18)19)20(17)12-14/h4-13H,1-3H3.
What are the key properties of 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine?
2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine has a molecular weight of 321.42 g/mol, XLogP of 6.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,9-dimethylfluoranthen-3-yl)-6-methylpyridine is sourced from PubChem (CID 134316394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).