5-(1,2-diphenylethenyl)-1H-imidazole

C17H14N2 — CID 76703178

IUPAC5-(1,2-diphenylethenyl)-1H-imidazole
SMILESC(=C(c1ccccc1)c1cnc[nH]1)c1ccccc1
InChIInChI=1S/C17H14N2/c1-3-7-14(8-4-1)11-16(17-12-18-13-19-17)15-9-5-2-6-10-15/h1-13H,(H,18,19)
InChIKeyVEVXKWPCQINBNL-UHFFFAOYSA-N
MW246.31 g/mol
LogP4.00
Rot. Bonds3

About 5-(1,2-diphenylethenyl)-1H-imidazole

5-(1,2-diphenylethenyl)-1H-imidazole (PubChem CID 76703178) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-(1,2-diphenylethenyl)-1H-imidazole.

Molecular Properties

Compound Name5-(1,2-diphenylethenyl)-1H-imidazole
PubChem CID76703178
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name5-(1,2-diphenylethenyl)-1H-imidazole
SMILESC(=C(c1ccccc1)c1cnc[nH]1)c1ccccc1
InChIInChI=1S/C17H14N2/c1-3-7-14(8-4-1)11-16(17-12-18-13-19-17)15-9-5-2-6-10-15/h1-13H,(H,18,19)
InChIKeyVEVXKWPCQINBNL-UHFFFAOYSA-N
XLogP4.00
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 173126547
CID 173126547
5-(1,2-diphenylethenyl)-1H-pyrazole
CID 70413300
CID 172843956
CID 172843956
1-[(Z)-1,2-diphenylethenyl]-4-[4-[(Z)-1,2-diphenylethenyl]phenyl]benzene
CID 173002469
1-(1,2-diphenylethenyl)-4-phenylbenzene
CID 54005685
1,2-diphenylethenylbenzene;quinoxaline
CID 175322673
1-[(E)-1,2-diphenylethenyl]-3-phenylbenzene
CID 121493700
1,4-bis[(E)-2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]benzene
CID 20678091
1-chloro-4-(1,2-diphenylethenyl)benzene
CID 58695106
2,5-bis[(E)-1,2-diphenylethenyl]thiophene
CID 12965056
1,2-diphenylethenylbenzene;furan
CID 175372951
2-[(E)-1,2-diphenylethenyl]-5-methyl-1,3-oxazole
CID 135014901

Frequently Asked Questions

What is the IUPAC name of 5-(1,2-diphenylethenyl)-1H-imidazole?
The IUPAC name of 5-(1,2-diphenylethenyl)-1H-imidazole (CID 76703178) is 5-(1,2-diphenylethenyl)-1H-imidazole.
What is the SMILES notation for 5-(1,2-diphenylethenyl)-1H-imidazole?
The canonical SMILES for 5-(1,2-diphenylethenyl)-1H-imidazole is C(=C(c1ccccc1)c1cnc[nH]1)c1ccccc1.
What is the InChIKey of 5-(1,2-diphenylethenyl)-1H-imidazole?
The InChIKey is VEVXKWPCQINBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-3-7-14(8-4-1)11-16(17-12-18-13-19-17)15-9-5-2-6-10-15/h1-13H,(H,18,19).
What are the key properties of 5-(1,2-diphenylethenyl)-1H-imidazole?
5-(1,2-diphenylethenyl)-1H-imidazole has a molecular weight of 246.31 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2-diphenylethenyl)-1H-imidazole is sourced from PubChem (CID 76703178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).