2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine

C18H15N — CID 90079269

IUPAC2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine
SMILESC/C(=C\c1ccccn1)c1cccc2ccccc12
InChIInChI=1S/C18H15N/c1-14(13-16-9-4-5-12-19-16)17-11-6-8-15-7-2-3-10-18(15)17/h2-13H,1H3/b14-13+
InChIKeyPTJDJAIBPVYZMJ-BUHFOSPRSA-N
MW245.32 g/mol
LogP4.80
Rot. Bonds2

About 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine

2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine (PubChem CID 90079269) has the molecular formula C18H15N and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine.

Molecular Properties

Compound Name2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine
PubChem CID90079269
Molecular FormulaC18H15N
Molecular Weight245.32 g/mol
Exact Mass245.12
IUPAC Name2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine
SMILESC/C(=C\c1ccccn1)c1cccc2ccccc12
InChIInChI=1S/C18H15N/c1-14(13-16-9-4-5-12-19-16)17-11-6-8-15-7-2-3-10-18(15)17/h2-13H,1H3/b14-13+
InChIKeyPTJDJAIBPVYZMJ-BUHFOSPRSA-N
XLogP4.80
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine?
The IUPAC name of 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine (CID 90079269) is 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine.
What is the SMILES notation for 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine?
The canonical SMILES for 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine is C/C(=C\c1ccccn1)c1cccc2ccccc12.
What is the InChIKey of 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine?
The InChIKey is PTJDJAIBPVYZMJ-BUHFOSPRSA-N. The full InChI is InChI=1S/C18H15N/c1-14(13-16-9-4-5-12-19-16)17-11-6-8-15-7-2-3-10-18(15)17/h2-13H,1H3/b14-13+.
What are the key properties of 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine?
2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine has a molecular weight of 245.32 g/mol, XLogP of 4.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-naphthalen-1-ylprop-1-enyl]pyridine is sourced from PubChem (CID 90079269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).