4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine

C31H21N — CID 71174823

IUPAC4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ccncc5)cc4)c4ccccc34)cccc2c1
InChIInChI=1S/C31H21N/c1-2-8-26-24(6-1)7-5-11-29(26)31-17-16-27(28-9-3-4-10-30(28)31)25-14-12-22(13-15-25)23-18-20-32-21-19-23/h1-21H
InChIKeyDYGVIUGDAMJAFG-UHFFFAOYSA-N
MW407.52 g/mol
LogP8.39
Rot. Bonds3

About 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine

4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine (PubChem CID 71174823) has the molecular formula C31H21N and a molecular weight of 407.52 g/mol. Its IUPAC name is 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine.

Molecular Properties

Compound Name4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine
PubChem CID71174823
Molecular FormulaC31H21N
Molecular Weight407.52 g/mol
Exact Mass407.17
IUPAC Name4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine
SMILESc1ccc2c(-c3ccc(-c4ccc(-c5ccncc5)cc4)c4ccccc34)cccc2c1
InChIInChI=1S/C31H21N/c1-2-8-26-24(6-1)7-5-11-29(26)31-17-16-27(28-9-3-4-10-30(28)31)25-14-12-22(13-15-25)23-18-20-32-21-19-23/h1-21H
InChIKeyDYGVIUGDAMJAFG-UHFFFAOYSA-N
XLogP8.39
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.52
LogP ≤ 58.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[2-(2-naphthalen-1-ylphenyl)phenyl]-3-phenylphenyl]-4,6-dipyridin-4-yl-1,3,5-triazine
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CID 130264412
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1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
1-naphthalen-1-ylnaphthalene;ruthenium(2+);dichloride
CID 11327769
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CID 175377735
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CID 141277666
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
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9-(4-naphthalen-1-ylphenyl)-10-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]anthracene
CID 59557524
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
4-(5-naphthalen-1-ylfuran-2-yl)pyridine
CID 56932024

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine?
The IUPAC name of 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine (CID 71174823) is 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine.
What is the SMILES notation for 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine?
The canonical SMILES for 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine is c1ccc2c(-c3ccc(-c4ccc(-c5ccncc5)cc4)c4ccccc34)cccc2c1.
What is the InChIKey of 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine?
The InChIKey is DYGVIUGDAMJAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21N/c1-2-8-26-24(6-1)7-5-11-29(26)31-17-16-27(28-9-3-4-10-30(28)31)25-14-12-22(13-15-25)23-18-20-32-21-19-23/h1-21H.
What are the key properties of 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine?
4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine has a molecular weight of 407.52 g/mol, XLogP of 8.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]pyridine is sourced from PubChem (CID 71174823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).