4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine

C20H19NO2 — CID 10268858

IUPAC4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine
SMILESCOCCOc1c(/C=C/c2ccncc2)ccc2ccccc12
InChIInChI=1S/C20H19NO2/c1-22-14-15-23-20-18(7-6-16-10-12-21-13-11-16)9-8-17-4-2-3-5-19(17)20/h2-13H,14-15H2,1H3/b7-6+
InChIKeyWWOHZJGWSUWDBZ-VOTSOKGWSA-N
MW305.38 g/mol
LogP4.43
Rot. Bonds6

About 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine

4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine (PubChem CID 10268858) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine.

Molecular Properties

Compound Name4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine
PubChem CID10268858
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine
SMILESCOCCOc1c(/C=C/c2ccncc2)ccc2ccccc12
InChIInChI=1S/C20H19NO2/c1-22-14-15-23-20-18(7-6-16-10-12-21-13-11-16)9-8-17-4-2-3-5-19(17)20/h2-13H,14-15H2,1H3/b7-6+
InChIKeyWWOHZJGWSUWDBZ-VOTSOKGWSA-N
XLogP4.43
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine?
The IUPAC name of 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine (CID 10268858) is 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine.
What is the SMILES notation for 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine?
The canonical SMILES for 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine is COCCOc1c(/C=C/c2ccncc2)ccc2ccccc12.
What is the InChIKey of 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine?
The InChIKey is WWOHZJGWSUWDBZ-VOTSOKGWSA-N. The full InChI is InChI=1S/C20H19NO2/c1-22-14-15-23-20-18(7-6-16-10-12-21-13-11-16)9-8-17-4-2-3-5-19(17)20/h2-13H,14-15H2,1H3/b7-6+.
What are the key properties of 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine?
4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine has a molecular weight of 305.38 g/mol, XLogP of 4.43, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-[1-(2-methoxyethoxy)naphthalen-2-yl]ethenyl]pyridine is sourced from PubChem (CID 10268858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).