5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine

C27H31N — CID 155602203

IUPAC5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
SMILESCc1cccc(C)c1-c1ccc(-c2ccc3c(c2)C(C)(C)CCC3(C)C)nc1
InChIInChI=1S/C27H31N/c1-18-8-7-9-19(2)25(18)21-11-13-24(28-17-21)20-10-12-22-23(16-20)27(5,6)15-14-26(22,3)4/h7-13,16-17H,14-15H2,1-6H3
InChIKeyIUMCPUHQVQUHJH-UHFFFAOYSA-N
MW369.55 g/mol
LogP7.38
Rot. Bonds2

About 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine

5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine (PubChem CID 155602203) has the molecular formula C27H31N and a molecular weight of 369.55 g/mol. Its IUPAC name is 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine.

Molecular Properties

Compound Name5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
PubChem CID155602203
Molecular FormulaC27H31N
Molecular Weight369.55 g/mol
Exact Mass369.25
IUPAC Name5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
SMILESCc1cccc(C)c1-c1ccc(-c2ccc3c(c2)C(C)(C)CCC3(C)C)nc1
InChIInChI=1S/C27H31N/c1-18-8-7-9-19(2)25(18)21-11-13-24(28-17-21)20-10-12-22-23(16-20)27(5,6)15-14-26(22,3)4/h7-13,16-17H,14-15H2,1-6H3
InChIKeyIUMCPUHQVQUHJH-UHFFFAOYSA-N
XLogP7.38
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.55
LogP ≤ 57.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridin-3-amine
CID 116525884
5-tert-butyl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
CID 118300467
5,5,8,8-tetramethyl-3-(4-methylphenyl)-6,7-dihydroisoquinoline
CID 129074693
5,5,8,8-tetramethyl-3-(3-phenylphenyl)-6,7-dihydroisoquinoline
CID 140789925
3-(2,6-dimethyl-3-pyridinyl)-5,5,8,8-tetramethyl-6,7-dihydroisoquinoline;ethane;5,5,8,8-tetramethyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-6,7-dihydroisoquinoline
CID 144898406
2-piperidin-4-yl-6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine
CID 53250882
5-[2-(3,5-dimethylphenyl)-3-[6-(1,1,2,2,3,3-hexamethylinden-5-yl)-3-pyridinyl]phenyl]-2-(1,1,2,2,3,3-hexamethylinden-5-yl)pyridine
CID 153422803
2-(1,8-dimethyl-11-oxatricyclo[6.2.1.02,7]undeca-2(7),3,5-trien-4-yl)-5-phenylpyridine
CID 118155074
trimethyl-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4-pyridinyl]silane
CID 156686707
8-[6-[4-phenyl-6-[3-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]-3-pyridinyl]quinoline
CID 171749073
2-[3-(2,6-dimethylphenyl)benzene-6-id-1-yl]pyridine;iridium;2-(5,5,8,8-tetramethyl-6,7-dihydro-3H-naphthalen-3-id-2-yl)pyridine
CID 140790010
3-(2,4-dimethylphenyl)-5,5,8,8-tetramethyl-6,7-dihydroisoquinoline
CID 170184396

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine?
The IUPAC name of 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine (CID 155602203) is 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine.
What is the SMILES notation for 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine?
The canonical SMILES for 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine is Cc1cccc(C)c1-c1ccc(-c2ccc3c(c2)C(C)(C)CCC3(C)C)nc1.
What is the InChIKey of 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine?
The InChIKey is IUMCPUHQVQUHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31N/c1-18-8-7-9-19(2)25(18)21-11-13-24(28-17-21)20-10-12-22-23(16-20)27(5,6)15-14-26(22,3)4/h7-13,16-17H,14-15H2,1-6H3.
What are the key properties of 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine?
5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine has a molecular weight of 369.55 g/mol, XLogP of 7.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethylphenyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridine is sourced from PubChem (CID 155602203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).