[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane

C31H22NP — CID 170290591

IUPAC[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
SMILESPc1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6ccccc56)nc4)cc3c2)cc1
InChIInChI=1S/C31H22NP/c33-28-15-12-21(13-16-28)24-10-8-22-9-11-25(19-27(22)18-24)26-14-17-31(32-20-26)30-7-3-5-23-4-1-2-6-29(23)30/h1-20H,33H2
InChIKeyJGYWBPAPAVIKAG-UHFFFAOYSA-N
MW439.50 g/mol
LogP7.89
Rot. Bonds3

About [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane

[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane (PubChem CID 170290591) has the molecular formula C31H22NP and a molecular weight of 439.50 g/mol. Its IUPAC name is [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane.

Molecular Properties

Compound Name[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
PubChem CID170290591
Molecular FormulaC31H22NP
Molecular Weight439.50 g/mol
Exact Mass439.15
IUPAC Name[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
SMILESPc1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6ccccc56)nc4)cc3c2)cc1
InChIInChI=1S/C31H22NP/c33-28-15-12-21(13-16-28)24-10-8-22-9-11-25(19-27(22)18-24)26-14-17-31(32-20-26)30-7-3-5-23-4-1-2-6-29(23)30/h1-20H,33H2
InChIKeyJGYWBPAPAVIKAG-UHFFFAOYSA-N
XLogP7.89
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.50
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[4-[7-(6-pyridin-2-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
CID 170290623
[4-[7-(6-pyridin-3-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane
CID 170290663
2-dibenzofuran-4-yl-5-naphthalen-2-ylpyridine
CID 171576906
2-naphthalen-1-yl-4-naphthalen-2-ylpyridine
CID 144888160
5-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]-2-pyridin-2-ylpyridine
CID 163823578
4,6-bis[4-[2-[3,5-bis[2-(6-naphthalen-1-yl-3-pyridinyl)phenyl]phenyl]phenyl]phenyl]pyrimidine
CID 138744139
[4-[7-(6-dibenzothiophen-4-yl-3-pyridinyl)naphthalen-2-yl]phenyl]-trimethylsilane
CID 169293440
2-[4-(7-naphthalen-1-ylnaphthalen-2-yl)phenyl]triphenylene
CID 123541562
1-[3-naphthalen-2-yl-5-[4-[4-(3-naphthalen-1-yl-5-naphthalen-2-ylphenyl)phenyl]phenyl]phenyl]naphthalene
CID 18710973
2,4-diphenyl-6-(6-picen-4-yl-3-pyridinyl)-1,3,5-triazine
CID 167087504
2-naphthalen-1-yl-4,6-bis(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 167133977
5-naphthalen-2-yl-2-(3-naphthalen-2-yl-10-phenanthren-2-ylanthracen-9-yl)pyridine
CID 89023620

Frequently Asked Questions

What is the IUPAC name of [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane?
The IUPAC name of [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane (CID 170290591) is [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane.
What is the SMILES notation for [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane?
The canonical SMILES for [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane is Pc1ccc(-c2ccc3ccc(-c4ccc(-c5cccc6ccccc56)nc4)cc3c2)cc1.
What is the InChIKey of [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane?
The InChIKey is JGYWBPAPAVIKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22NP/c33-28-15-12-21(13-16-28)24-10-8-22-9-11-25(19-27(22)18-24)26-14-17-31(32-20-26)30-7-3-5-23-4-1-2-6-29(23)30/h1-20H,33H2.
What are the key properties of [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane?
[4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane has a molecular weight of 439.50 g/mol, XLogP of 7.89, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[7-(6-naphthalen-1-yl-3-pyridinyl)naphthalen-2-yl]phenyl]phosphane is sourced from PubChem (CID 170290591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).