2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine

C19H15N — CID 90870778

IUPAC2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine
SMILESC(C=Cc1ccccn1)=Cc1ccc2ccccc2c1
InChIInChI=1S/C19H15N/c1(4-10-19-11-5-6-14-20-19)7-16-12-13-17-8-2-3-9-18(17)15-16/h1-15H
InChIKeyDRXGLZDGCXMVHL-UHFFFAOYSA-N
MW257.34 g/mol
LogP4.96
Rot. Bonds3

About 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine

2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine (PubChem CID 90870778) has the molecular formula C19H15N and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine.

Molecular Properties

Compound Name2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine
PubChem CID90870778
Molecular FormulaC19H15N
Molecular Weight257.34 g/mol
Exact Mass257.12
IUPAC Name2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine
SMILESC(C=Cc1ccccn1)=Cc1ccc2ccccc2c1
InChIInChI=1S/C19H15N/c1(4-10-19-11-5-6-14-20-19)7-16-12-13-17-8-2-3-9-18(17)15-16/h1-15H
InChIKeyDRXGLZDGCXMVHL-UHFFFAOYSA-N
XLogP4.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[(1E,3E)-4-(4-methoxyphenyl)buta-1,3-dienyl]pyridine
CID 87145440
2-(6-phenylhexa-1,3,5-trienyl)naphthalene
CID 2818391
2-[(1E,3E)-penta-1,3-dienyl]naphthalene
CID 135079977
2-(4-pyridin-2-ylbuta-1,3-dienyl)quinoline
CID 91436844
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
5-[(1E,3E)-4-pyridin-2-ylbuta-1,3-dienyl]pyrimidine
CID 87145403
7-(4-pyridin-2-ylbuta-1,3-dienyl)imidazo[1,2-a]pyridine
CID 90750973
(2E)-5-pyridin-2-ylpenta-2,4-dienal
CID 87959329
2-(2-pyridin-2-ylethenyl)pyridine
CID 161029843
2-[2-[3,5-bis(2-pyridin-2-ylethenyl)phenyl]ethenyl]pyridine
CID 5076981
2-[(Z)-2-anthracen-2-ylethenyl]anthracene
CID 101144533
3-(2-pyridin-2-ylethenyl)quinoline
CID 66775242

Frequently Asked Questions

What is the IUPAC name of 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine?
The IUPAC name of 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine (CID 90870778) is 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine.
What is the SMILES notation for 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine?
The canonical SMILES for 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine is C(C=Cc1ccccn1)=Cc1ccc2ccccc2c1.
What is the InChIKey of 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine?
The InChIKey is DRXGLZDGCXMVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N/c1(4-10-19-11-5-6-14-20-19)7-16-12-13-17-8-2-3-9-18(17)15-16/h1-15H.
What are the key properties of 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine?
2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine has a molecular weight of 257.34 g/mol, XLogP of 4.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-naphthalen-2-ylbuta-1,3-dienyl)pyridine is sourced from PubChem (CID 90870778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).