2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine

C162H212N8 — CID 159772988

IUPAC2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine
SMILESCC(C)(C)c1cc(-c2cccnc2)cc(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc3cccnc3c3ncccc23)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccnc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C
InChIInChI=1S/C33H39N3.C30H36N2.C28H36N2.2C24H34.C23H33N/c1-31(2,3)24-17-16-23(29(32(4,5)6)30(24)33(7,8)9)22-20-27(25-14-10-12-18-34-25)36-28(21-22)26-15-11-13-19-35-26;1-28(2,3)23-15-14-20(24(29(4,5)6)25(23)30(7,8)9)22-18-19-12-10-16-31-26(19)27-21(22)13-11-17-32-27;1-26(2,3)21-14-13-20(24(27(4,5)6)25(21)28(7,8)9)19-15-17-30-23(18-19)22-12-10-11-16-29-22;2*1-22(2,3)19-16-15-18(17-13-11-10-12-14-17)20(23(4,5)6)21(19)24(7,8)9;1-21(2,3)18-13-17(16-11-10-12-24-15-16)14-19(22(4,5)6)20(18)23(7,8)9/h10-21H,1-9H3;10-18H,1-9H3;10-18H,1-9H3;2*10-16H,1-9H3;10-15H,1-9H3
InChIKeyNGJAZABKBQCONN-UHFFFAOYSA-N
MW2271.53 g/mol
LogP45.94
Rot. Bonds9

About 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine

2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine (PubChem CID 159772988) has the molecular formula C162H212N8 and a molecular weight of 2271.53 g/mol. Its IUPAC name is 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine.

Molecular Properties

Compound Name2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine
PubChem CID159772988
Molecular FormulaC162H212N8
Molecular Weight2271.53 g/mol
Exact Mass2269.68
IUPAC Name2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine
SMILESCC(C)(C)c1cc(-c2cccnc2)cc(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc3cccnc3c3ncccc23)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccnc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C
InChIInChI=1S/C33H39N3.C30H36N2.C28H36N2.2C24H34.C23H33N/c1-31(2,3)24-17-16-23(29(32(4,5)6)30(24)33(7,8)9)22-20-27(25-14-10-12-18-34-25)36-28(21-22)26-15-11-13-19-35-26;1-28(2,3)23-15-14-20(24(29(4,5)6)25(23)30(7,8)9)22-18-19-12-10-16-31-26(19)27-21(22)13-11-17-32-27;1-26(2,3)21-14-13-20(24(27(4,5)6)25(21)28(7,8)9)19-15-17-30-23(18-19)22-12-10-11-16-29-22;2*1-22(2,3)19-16-15-18(17-13-11-10-12-14-17)20(23(4,5)6)21(19)24(7,8)9;1-21(2,3)18-13-17(16-11-10-12-24-15-16)14-19(22(4,5)6)20(18)23(7,8)9/h10-21H,1-9H3;10-18H,1-9H3;10-18H,1-9H3;2*10-16H,1-9H3;10-15H,1-9H3
InChIKeyNGJAZABKBQCONN-UHFFFAOYSA-N
XLogP45.94
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms170
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002271.53
LogP ≤ 545.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine with MolForge

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Related Compounds

4-[4-(3,5-dipyridin-3-ylphenyl)naphthalen-1-yl]-2,7-diphenyl-1,10-phenanthroline
CID 155336974
5-(2,4-ditert-butyl-3-ethylphenyl)-1,10-phenanthroline
CID 142526098
2,6-dipyridin-2-yl-4-[4-(3-pyridin-2-yl-5-pyridin-4-ylphenyl)naphthalen-1-yl]pyridine
CID 126730917
2,6-dipyridin-2-yl-4-[4-(3-pyridin-3-ylphenyl)phenyl]pyridine
CID 126730922
4-[4-(3,5-dipyridin-3-ylphenyl)phenyl]-2,7-diphenyl-1,10-phenanthroline
CID 155336393
3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-10-phenyl-6-pyridin-3-ylphenanthridine
CID 146549128
6-(2,6-dipyridin-2-yl-4-pyridinyl)-2-(4-pyrimidin-2-ylphenyl)-1,10-phenanthroline
CID 158047088
3-[2-(4-tert-butylnaphthalen-2-yl)-4-pyridinyl]furo[3,2-b]pyridine
CID 171741540
5-[2-(4-naphthalen-1-ylphenyl)-6-(4-pyridin-3-ylnaphthalen-1-yl)pyrimidin-4-yl]-1,10-phenanthroline
CID 162774161
5,8-ditert-butyl-2,3-bis(4-pyridin-2-ylphenyl)quinoxaline;5,8-dimethyl-2,3-bis(4-pyridin-2-ylphenyl)quinoxaline;5,8-dimethyl-2,3-bis(4-pyridin-3-ylphenyl)quinoxaline;5,8-dimethyl-2,3-bis(4-pyridin-4-ylphenyl)quinoxaline
CID 157339498
5-[3-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]-5-(1,10-phenanthrolin-5-yl)phenyl]-1,10-phenanthroline
CID 153466098
4-(3-pyridin-2-ylphenyl)-2-[4-(3-pyridin-3-ylphenyl)-2-pyridinyl]pyridine
CID 130326858

Frequently Asked Questions

What is the IUPAC name of 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine?
The IUPAC name of 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine (CID 159772988) is 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine.
What is the SMILES notation for 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine?
The canonical SMILES for 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine is CC(C)(C)c1cc(-c2cccnc2)cc(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2cc3cccnc3c3ncccc23)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccccc2)c(C(C)(C)C)c1C(C)(C)C.CC(C)(C)c1ccc(-c2ccnc(-c3ccccn3)c2)c(C(C)(C)C)c1C(C)(C)C.
What is the InChIKey of 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine?
The InChIKey is NGJAZABKBQCONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H39N3.C30H36N2.C28H36N2.2C24H34.C23H33N/c1-31(2,3)24-17-16-23(29(32(4,5)6)30(24)33(7,8)9)22-20-27(25-14-10-12-18-34-25)36-28(21-22)26-15-11-13-19-35-26;1-28(2,3)23-15-14-20(24(29(4,5)6)25(23)30(7,8)9)22-18-19-12-10-16-31-26(19)27-21(22)13-11-17-32-27;1-26(2,3)21-14-13-20(24(27(4,5)6)25(21)28(7,8)9)19-15-17-30-23(18-19)22-12-10-11-16-29-22;2*1-22(2,3)19-16-15-18(17-13-11-10-12-14-17)20(23(4,5)6)21(19)24(7,8)9;1-21(2,3)18-13-17(16-11-10-12-24-15-16)14-19(22(4,5)6)20(18)23(7,8)9/h10-21H,1-9H3;10-18H,1-9H3;10-18H,1-9H3;2*10-16H,1-9H3;10-15H,1-9H3.
What are the key properties of 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine?
2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine has a molecular weight of 2271.53 g/mol, XLogP of 45.94, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine is sourced from PubChem (CID 159772988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).