4-(1,2,2-tripyridin-4-ylethenyl)pyridine

C22H16N4 — CID 154027543

IUPAC4-(1,2,2-tripyridin-4-ylethenyl)pyridine
SMILESc1cc(C(=C(c2ccncc2)c2ccncc2)c2ccncc2)ccn1
InChIInChI=1S/C22H16N4/c1-9-23-10-2-17(1)21(18-3-11-24-12-4-18)22(19-5-13-25-14-6-19)20-7-15-26-16-8-20/h1-16H
InChIKeyZTIDKYAFTJKSNT-UHFFFAOYSA-N
MW336.40 g/mol
LogP4.27
Rot. Bonds4

About 4-(1,2,2-tripyridin-4-ylethenyl)pyridine

4-(1,2,2-tripyridin-4-ylethenyl)pyridine (PubChem CID 154027543) has the molecular formula C22H16N4 and a molecular weight of 336.40 g/mol. Its IUPAC name is 4-(1,2,2-tripyridin-4-ylethenyl)pyridine.

Molecular Properties

Compound Name4-(1,2,2-tripyridin-4-ylethenyl)pyridine
PubChem CID154027543
Molecular FormulaC22H16N4
Molecular Weight336.40 g/mol
Exact Mass336.14
IUPAC Name4-(1,2,2-tripyridin-4-ylethenyl)pyridine
SMILESc1cc(C(=C(c2ccncc2)c2ccncc2)c2ccncc2)ccn1
InChIInChI=1S/C22H16N4/c1-9-23-10-2-17(1)21(18-3-11-24-12-4-18)22(19-5-13-25-14-6-19)20-7-15-26-16-8-20/h1-16H
InChIKeyZTIDKYAFTJKSNT-UHFFFAOYSA-N
XLogP4.27
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(1,2,2-tripyridin-4-ylethenyl)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 4-(1,2,2-tripyridin-4-ylethenyl)pyridine?
The IUPAC name of 4-(1,2,2-tripyridin-4-ylethenyl)pyridine (CID 154027543) is 4-(1,2,2-tripyridin-4-ylethenyl)pyridine.
What is the SMILES notation for 4-(1,2,2-tripyridin-4-ylethenyl)pyridine?
The canonical SMILES for 4-(1,2,2-tripyridin-4-ylethenyl)pyridine is c1cc(C(=C(c2ccncc2)c2ccncc2)c2ccncc2)ccn1.
What is the InChIKey of 4-(1,2,2-tripyridin-4-ylethenyl)pyridine?
The InChIKey is ZTIDKYAFTJKSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4/c1-9-23-10-2-17(1)21(18-3-11-24-12-4-18)22(19-5-13-25-14-6-19)20-7-15-26-16-8-20/h1-16H.
What are the key properties of 4-(1,2,2-tripyridin-4-ylethenyl)pyridine?
4-(1,2,2-tripyridin-4-ylethenyl)pyridine has a molecular weight of 336.40 g/mol, XLogP of 4.27, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,2-tripyridin-4-ylethenyl)pyridine is sourced from PubChem (CID 154027543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).