2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine

C38H26N4 — CID 166593500

IUPAC2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine
SMILESC1=CCc2c3c(c4ccc(-c5ccc(-c6ccccn6)nc5)cc4c2=C1)=CCC(c1ccc(-c2ccccn2)nc1)=C3
InChIInChI=1S/C38H26N4/c1-2-8-30-29(7-1)33-21-25(27-13-17-37(41-23-27)35-9-3-5-19-39-35)11-15-31(33)32-16-12-26(22-34(30)32)28-14-18-38(42-24-28)36-10-4-6-20-40-36/h1-7,9-11,13-24H,8,12H2
InChIKeyIBMMOWZDNZRWKK-UHFFFAOYSA-N
MW538.65 g/mol
LogP7.04
Rot. Bonds4

About 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine

2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine (PubChem CID 166593500) has the molecular formula C38H26N4 and a molecular weight of 538.65 g/mol. Its IUPAC name is 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine.

Molecular Properties

Compound Name2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine
PubChem CID166593500
Molecular FormulaC38H26N4
Molecular Weight538.65 g/mol
Exact Mass538.22
IUPAC Name2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine
SMILESC1=CCc2c3c(c4ccc(-c5ccc(-c6ccccn6)nc5)cc4c2=C1)=CCC(c1ccc(-c2ccccn2)nc1)=C3
InChIInChI=1S/C38H26N4/c1-2-8-30-29(7-1)33-21-25(27-13-17-37(41-23-27)35-9-3-5-19-39-35)11-15-31(33)32-16-12-26(22-34(30)32)28-14-18-38(42-24-28)36-10-4-6-20-40-36/h1-7,9-11,13-24H,8,12H2
InChIKeyIBMMOWZDNZRWKK-UHFFFAOYSA-N
XLogP7.04
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500538.65
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine with MolForge

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Related Compounds

5-[6,10-bis(6-pyridin-2-yl-3-pyridinyl)triphenylen-2-yl]-2-(1,2-dihydropyridin-6-yl)pyridine
CID 130312510
2-(1,2-dihydropyridin-6-yl)-5-[3-phenyl-10-(6-pyridin-2-yl-3-pyridinyl)anthracen-9-yl]pyridine
CID 167110101
2-(6-pyridin-2-yl-3-pyridinyl)-5-[3-[7-[6-[6-(6-pyridin-2-yl-3-pyridinyl)-3-pyridinyl]-3-pyridinyl]triphenylen-2-yl]-1,2-dihydropyridin-6-yl]pyridine
CID 130312541
2-[5-[6,10-bis[6-(5-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]-5-pyridin-2-ylpyridine;2-pyridin-2-yl-5-[5-[11-[6-(6-pyridin-2-yl-3-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]pyridine;2-pyridin-3-yl-5-[5-[11-[6-(6-pyridin-3-yl-3-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]pyridine
CID 158248176
2-phenyl-4-(4-phenylphenyl)-6-[8-(6-pyridin-2-yl-3-pyridinyl)dibenzothiophen-2-yl]-1,3,5-triazine
CID 134380771
4-(6-pyridin-2-yl-3-pyridinyl)aniline
CID 129035516
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
CID 59724442
N-methylaniline;N-methyl-3-(6-pyridin-2-yl-3-pyridinyl)aniline
CID 143267232
2-[3-[3-(3-cyclopenta-1,3-dien-1-yl-5-phenylphenyl)phenyl]phenyl]pyridine
CID 140595202
2,4-diphenyl-6-[4-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]phenyl]pyrimidine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyrimidine
CID 167549240
5-[4-[7-tert-butyl-3-[4-(6-pyridin-2-yl-3-pyridinyl)phenyl]pyren-1-yl]phenyl]-2-pyridin-2-ylpyridine
CID 58028855
2,6-dipyridin-2-yl-4-[4-[3-pyridin-2-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyridine
CID 126730919

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine?
The IUPAC name of 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine (CID 166593500) is 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine.
What is the SMILES notation for 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine?
The canonical SMILES for 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine is C1=CCc2c3c(c4ccc(-c5ccc(-c6ccccn6)nc5)cc4c2=C1)=CCC(c1ccc(-c2ccccn2)nc1)=C3.
What is the InChIKey of 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine?
The InChIKey is IBMMOWZDNZRWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N4/c1-2-8-30-29(7-1)33-21-25(27-13-17-37(41-23-27)35-9-3-5-19-39-35)11-15-31(33)32-16-12-26(22-34(30)32)28-14-18-38(42-24-28)36-10-4-6-20-40-36/h1-7,9-11,13-24H,8,12H2.
What are the key properties of 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine?
2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine has a molecular weight of 538.65 g/mol, XLogP of 7.04, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-5-[7-(6-pyridin-2-yl-3-pyridinyl)-3,12-dihydrotriphenylen-2-yl]pyridine is sourced from PubChem (CID 166593500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).