2-(1,1-dinaphthalen-2-ylethyl)pyridine

C27H21N — CID 58756195

IUPAC2-(1,1-dinaphthalen-2-ylethyl)pyridine
SMILESCC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)c1ccccn1
InChIInChI=1S/C27H21N/c1-27(26-12-6-7-17-28-26,24-15-13-20-8-2-4-10-22(20)18-24)25-16-14-21-9-3-5-11-23(21)19-25/h2-19H,1H3
InChIKeyGSRGMXFOGPZAAA-UHFFFAOYSA-N
MW359.47 g/mol
LogP6.74
Rot. Bonds3

About 2-(1,1-dinaphthalen-2-ylethyl)pyridine

2-(1,1-dinaphthalen-2-ylethyl)pyridine (PubChem CID 58756195) has the molecular formula C27H21N and a molecular weight of 359.47 g/mol. Its IUPAC name is 2-(1,1-dinaphthalen-2-ylethyl)pyridine.

Molecular Properties

Compound Name2-(1,1-dinaphthalen-2-ylethyl)pyridine
PubChem CID58756195
Molecular FormulaC27H21N
Molecular Weight359.47 g/mol
Exact Mass359.17
IUPAC Name2-(1,1-dinaphthalen-2-ylethyl)pyridine
SMILESCC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)c1ccccn1
InChIInChI=1S/C27H21N/c1-27(26-12-6-7-17-28-26,24-15-13-20-8-2-4-10-22(20)18-24)25-16-14-21-9-3-5-11-23(21)19-25/h2-19H,1H3
InChIKeyGSRGMXFOGPZAAA-UHFFFAOYSA-N
XLogP6.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1-dinaphthalen-2-ylethyl)pyridine?
The IUPAC name of 2-(1,1-dinaphthalen-2-ylethyl)pyridine (CID 58756195) is 2-(1,1-dinaphthalen-2-ylethyl)pyridine.
What is the SMILES notation for 2-(1,1-dinaphthalen-2-ylethyl)pyridine?
The canonical SMILES for 2-(1,1-dinaphthalen-2-ylethyl)pyridine is CC(c1ccc2ccccc2c1)(c1ccc2ccccc2c1)c1ccccn1.
What is the InChIKey of 2-(1,1-dinaphthalen-2-ylethyl)pyridine?
The InChIKey is GSRGMXFOGPZAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21N/c1-27(26-12-6-7-17-28-26,24-15-13-20-8-2-4-10-22(20)18-24)25-16-14-21-9-3-5-11-23(21)19-25/h2-19H,1H3.
What are the key properties of 2-(1,1-dinaphthalen-2-ylethyl)pyridine?
2-(1,1-dinaphthalen-2-ylethyl)pyridine has a molecular weight of 359.47 g/mol, XLogP of 6.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-dinaphthalen-2-ylethyl)pyridine is sourced from PubChem (CID 58756195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).