2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine

C20H15N3 — CID 166001630

IUPAC2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine
SMILESC(=C/c1cn2cccnc2n1)\c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H15N3/c1-2-5-17(6-3-1)18-10-7-16(8-11-18)9-12-19-15-23-14-4-13-21-20(23)22-19/h1-15H/b12-9+
InChIKeyDXMQXBYQZJOMEK-FMIVXFBMSA-N
MW297.36 g/mol
LogP4.57
Rot. Bonds3

About 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine

2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine (PubChem CID 166001630) has the molecular formula C20H15N3 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine
PubChem CID166001630
Molecular FormulaC20H15N3
Molecular Weight297.36 g/mol
Exact Mass297.13
IUPAC Name2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine
SMILESC(=C/c1cn2cccnc2n1)\c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H15N3/c1-2-5-17(6-3-1)18-10-7-16(8-11-18)9-12-19-15-23-14-4-13-21-20(23)22-19/h1-15H/b12-9+
InChIKeyDXMQXBYQZJOMEK-FMIVXFBMSA-N
XLogP4.57
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine (CID 166001630) is 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine is C(=C/c1cn2cccnc2n1)\c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine?
The InChIKey is DXMQXBYQZJOMEK-FMIVXFBMSA-N. The full InChI is InChI=1S/C20H15N3/c1-2-5-17(6-3-1)18-10-7-16(8-11-18)9-12-19-15-23-14-4-13-21-20(23)22-19/h1-15H/b12-9+.
What are the key properties of 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine?
2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine has a molecular weight of 297.36 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-phenylphenyl)ethenyl]imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 166001630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).