2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine

C30H24N6 — CID 58836181

IUPAC2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine
SMILESCc1ncc(-c2cccc(-c3ccccc3-c3ccccc3-c3cccc(-c4cnc(C)[nH]4)n3)n2)[nH]1
InChIInChI=1S/C30H24N6/c1-19-31-17-29(33-19)27-15-7-13-25(35-27)23-11-5-3-9-21(23)22-10-4-6-12-24(22)26-14-8-16-28(36-26)30-18-32-20(2)34-30/h3-18H,1-2H3,(H,31,33)(H,32,34)
InChIKeyGHQOPFPYCKYOPV-UHFFFAOYSA-N
MW468.56 g/mol
LogP6.87
Rot. Bonds5

About 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine

2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine (PubChem CID 58836181) has the molecular formula C30H24N6 and a molecular weight of 468.56 g/mol. Its IUPAC name is 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine.

Molecular Properties

Compound Name2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine
PubChem CID58836181
Molecular FormulaC30H24N6
Molecular Weight468.56 g/mol
Exact Mass468.21
IUPAC Name2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine
SMILESCc1ncc(-c2cccc(-c3ccccc3-c3ccccc3-c3cccc(-c4cnc(C)[nH]4)n3)n2)[nH]1
InChIInChI=1S/C30H24N6/c1-19-31-17-29(33-19)27-15-7-13-25(35-27)23-11-5-3-9-21(23)22-10-4-6-12-24(22)26-14-8-16-28(36-26)30-18-32-20(2)34-30/h3-18H,1-2H3,(H,31,33)(H,32,34)
InChIKeyGHQOPFPYCKYOPV-UHFFFAOYSA-N
XLogP6.87
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.56
LogP ≤ 56.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine?
The IUPAC name of 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine (CID 58836181) is 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine.
What is the SMILES notation for 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine?
The canonical SMILES for 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine is Cc1ncc(-c2cccc(-c3ccccc3-c3ccccc3-c3cccc(-c4cnc(C)[nH]4)n3)n2)[nH]1.
What is the InChIKey of 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine?
The InChIKey is GHQOPFPYCKYOPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N6/c1-19-31-17-29(33-19)27-15-7-13-25(35-27)23-11-5-3-9-21(23)22-10-4-6-12-24(22)26-14-8-16-28(36-26)30-18-32-20(2)34-30/h3-18H,1-2H3,(H,31,33)(H,32,34).
What are the key properties of 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine?
2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine has a molecular weight of 468.56 g/mol, XLogP of 6.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-imidazol-5-yl)-6-[2-[2-[6-(2-methyl-1H-imidazol-5-yl)-2-pyridinyl]phenyl]phenyl]pyridine is sourced from PubChem (CID 58836181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).