2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine

C39H25N — CID 118487396

IUPAC2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine
SMILESc1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)ccc3c2)nc1
InChIInChI=1S/C39H25N/c1-2-12-31-26(10-1)11-9-17-32(31)39-35-15-5-3-13-33(35)38(34-14-4-6-16-36(34)39)30-22-20-27-24-29(21-19-28(27)25-30)37-18-7-8-23-40-37/h1-25H
InChIKeyVUWBGNQCLZDRPY-UHFFFAOYSA-N
MW507.64 g/mol
LogP10.70
Rot. Bonds3

About 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine

2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine (PubChem CID 118487396) has the molecular formula C39H25N and a molecular weight of 507.64 g/mol. Its IUPAC name is 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine.

Molecular Properties

Compound Name2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine
PubChem CID118487396
Molecular FormulaC39H25N
Molecular Weight507.64 g/mol
Exact Mass507.20
IUPAC Name2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine
SMILESc1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)ccc3c2)nc1
InChIInChI=1S/C39H25N/c1-2-12-31-26(10-1)11-9-17-32(31)39-35-15-5-3-13-33(35)38(34-14-4-6-16-36(34)39)30-22-20-27-24-29(21-19-28(27)25-30)37-18-7-8-23-40-37/h1-25H
InChIKeyVUWBGNQCLZDRPY-UHFFFAOYSA-N
XLogP10.70
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500507.64
LogP ≤ 510.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

5-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]-2-pyridin-2-ylpyridine
CID 163823578
2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]pyridine
CID 118487428
2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine
CID 90361806
10-naphthalen-1-yl-5-[6-(10-naphthalen-1-ylbenzo[g]quinolin-5-yl)naphthalen-2-yl]benzo[g]quinoline
CID 59184004
9-naphthalen-1-yl-10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracene
CID 58876135
ethane;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene
CID 91401240
9-naphthalen-1-yl-10-[6-(6-naphthalen-1-ylnaphthalen-2-yl)naphthalen-2-yl]anthracene
CID 123515173
2-[21-(10-naphthalen-2-ylanthracen-9-yl)-10-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8(13),9,11,15,17,19,21-undecaenyl]pyridine
CID 59582996
2-[4-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]naphthalen-1-yl]pyridine
CID 88552190
2-[4-(1,4,5,8-tetradeuterio-10-naphthalen-1-ylanthracen-9-yl)phenyl]pyridine
CID 176646872
2-[4-[4-[10-(6-ethylnaphthalen-2-yl)anthracen-9-yl]naphthalen-1-yl]phenyl]pyridine
CID 88551743
5,10-bis(6-naphthalen-1-ylnaphthalen-2-yl)benzo[g]quinoline
CID 59183508

Frequently Asked Questions

What is the IUPAC name of 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine?
The IUPAC name of 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine (CID 118487396) is 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine.
What is the SMILES notation for 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine?
The canonical SMILES for 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine is c1ccc(-c2ccc3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)ccc3c2)nc1.
What is the InChIKey of 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine?
The InChIKey is VUWBGNQCLZDRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N/c1-2-12-31-26(10-1)11-9-17-32(31)39-35-15-5-3-13-33(35)38(34-14-4-6-16-36(34)39)30-22-20-27-24-29(21-19-28(27)25-30)37-18-7-8-23-40-37/h1-25H.
What are the key properties of 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine?
2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine has a molecular weight of 507.64 g/mol, XLogP of 10.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine is sourced from PubChem (CID 118487396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).