3-(5-methylnaphthalen-2-yl)pyridine

C16H13N — CID 126628486

IUPAC3-(5-methylnaphthalen-2-yl)pyridine
SMILESCc1cccc2cc(-c3cccnc3)ccc12
InChIInChI=1S/C16H13N/c1-12-4-2-5-14-10-13(7-8-16(12)14)15-6-3-9-17-11-15/h2-11H,1H3
InChIKeyVRHMRBZZYINYGU-UHFFFAOYSA-N
MW219.29 g/mol
LogP4.21
Rot. Bonds1

About 3-(5-methylnaphthalen-2-yl)pyridine

3-(5-methylnaphthalen-2-yl)pyridine (PubChem CID 126628486) has the molecular formula C16H13N and a molecular weight of 219.29 g/mol. Its IUPAC name is 3-(5-methylnaphthalen-2-yl)pyridine.

Molecular Properties

Compound Name3-(5-methylnaphthalen-2-yl)pyridine
PubChem CID126628486
Molecular FormulaC16H13N
Molecular Weight219.29 g/mol
Exact Mass219.10
IUPAC Name3-(5-methylnaphthalen-2-yl)pyridine
SMILESCc1cccc2cc(-c3cccnc3)ccc12
InChIInChI=1S/C16H13N/c1-12-4-2-5-14-10-13(7-8-16(12)14)15-6-3-9-17-11-15/h2-11H,1H3
InChIKeyVRHMRBZZYINYGU-UHFFFAOYSA-N
XLogP4.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methylnaphthalen-2-yl)pyridine?
The IUPAC name of 3-(5-methylnaphthalen-2-yl)pyridine (CID 126628486) is 3-(5-methylnaphthalen-2-yl)pyridine.
What is the SMILES notation for 3-(5-methylnaphthalen-2-yl)pyridine?
The canonical SMILES for 3-(5-methylnaphthalen-2-yl)pyridine is Cc1cccc2cc(-c3cccnc3)ccc12.
What is the InChIKey of 3-(5-methylnaphthalen-2-yl)pyridine?
The InChIKey is VRHMRBZZYINYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N/c1-12-4-2-5-14-10-13(7-8-16(12)14)15-6-3-9-17-11-15/h2-11H,1H3.
What are the key properties of 3-(5-methylnaphthalen-2-yl)pyridine?
3-(5-methylnaphthalen-2-yl)pyridine has a molecular weight of 219.29 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylnaphthalen-2-yl)pyridine is sourced from PubChem (CID 126628486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).