4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine

C34H25N — CID 170294286

IUPAC4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine
SMILESCc1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccncc6)cc5)cc4c3)cc2)cc1
InChIInChI=1S/C34H25N/c1-24-2-4-25(5-3-24)26-6-10-28(11-7-26)32-16-14-30-15-17-33(23-34(30)22-32)29-12-8-27(9-13-29)31-18-20-35-21-19-31/h2-23H,1H3
InChIKeyLZLZCBCRYPTXKJ-UHFFFAOYSA-N
MW447.58 g/mol
LogP9.21
Rot. Bonds4

About 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine

4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine (PubChem CID 170294286) has the molecular formula C34H25N and a molecular weight of 447.58 g/mol. Its IUPAC name is 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine.

Molecular Properties

Compound Name4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine
PubChem CID170294286
Molecular FormulaC34H25N
Molecular Weight447.58 g/mol
Exact Mass447.20
IUPAC Name4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine
SMILESCc1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccncc6)cc5)cc4c3)cc2)cc1
InChIInChI=1S/C34H25N/c1-24-2-4-25(5-3-24)26-6-10-28(11-7-26)32-16-14-30-15-17-33(23-34(30)22-32)29-12-8-27(9-13-29)31-18-20-35-21-19-31/h2-23H,1H3
InChIKeyLZLZCBCRYPTXKJ-UHFFFAOYSA-N
XLogP9.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.58
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The IUPAC name of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine (CID 170294286) is 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine.
What is the SMILES notation for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The canonical SMILES for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine is Cc1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccncc6)cc5)cc4c3)cc2)cc1.
What is the InChIKey of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The InChIKey is LZLZCBCRYPTXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H25N/c1-24-2-4-25(5-3-24)26-6-10-28(11-7-26)32-16-14-30-15-17-33(23-34(30)22-32)29-12-8-27(9-13-29)31-18-20-35-21-19-31/h2-23H,1H3.
What are the key properties of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine has a molecular weight of 447.58 g/mol, XLogP of 9.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine is sourced from PubChem (CID 170294286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).