5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one

C23H15N3O — CID 141051178

IUPAC5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one
SMILESO=C1C=Cc2cc(-c3nc(-c4ccccc4)[nH]c3-c3ccncc3)ccc21
InChIInChI=1S/C23H15N3O/c27-20-9-7-17-14-18(6-8-19(17)20)22-21(15-10-12-24-13-11-15)25-23(26-22)16-4-2-1-3-5-16/h1-14H,(H,25,26)
InChIKeyRFXKEDTXEOLXSR-UHFFFAOYSA-N
MW349.39 g/mol
LogP5.02
Rot. Bonds3

About 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one

5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one (PubChem CID 141051178) has the molecular formula C23H15N3O and a molecular weight of 349.39 g/mol. Its IUPAC name is 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one.

Molecular Properties

Compound Name5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one
PubChem CID141051178
Molecular FormulaC23H15N3O
Molecular Weight349.39 g/mol
Exact Mass349.12
IUPAC Name5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one
SMILESO=C1C=Cc2cc(-c3nc(-c4ccccc4)[nH]c3-c3ccncc3)ccc21
InChIInChI=1S/C23H15N3O/c27-20-9-7-17-14-18(6-8-19(17)20)22-21(15-10-12-24-13-11-15)25-23(26-22)16-4-2-1-3-5-16/h1-14H,(H,25,26)
InChIKeyRFXKEDTXEOLXSR-UHFFFAOYSA-N
XLogP5.02
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.39
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-[4-[3-(methylamino)propoxy]phenyl]-5-pyridin-4-yl-1H-imidazol-4-yl]inden-1-one
CID 141051162
4-[4-(4-chlorophenyl)-2-phenyl-1H-imidazol-5-yl]pyridine
CID 10664282
2-chloro-5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)phenol;hydrochloride
CID 44533820
5-[4-[4-(2,4-diphenyl-1H-imidazol-5-yl)phenyl]phenyl]-2,4-diphenyl-1H-imidazole
CID 3106607
4-phenyl-2,5-bis(4-phenylphenyl)-1H-imidazole
CID 134113623
N-hydroxy-3-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)benzamide
CID 88918376
2,7-bis[2-(4-methoxyphenyl)-5-phenyl-1H-imidazol-4-yl]fluoren-9-one
CID 6617735
2-[2-bromo-4-(4,5-diphenyl-1H-imidazol-2-yl)phenyl]-4,5-diphenyl-1H-imidazole
CID 146679981
2,7-bis[2-(3-iodophenyl)-5-phenyl-1H-imidazol-4-yl]fluoren-9-one
CID 3112521
3-[2-(4-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]-6-[2-(4-methoxyphenyl)-5-phenyl-1H-imidazol-4-yl]fluoren-9-one
CID 135420505
4-[4-[3-[2-(4-carboxyphenyl)-5-phenyl-1H-imidazol-4-yl]phenyl]-5-phenyl-1H-imidazol-2-yl]benzoic acid
CID 3123820
[2-cyclopropyl-4-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)phenyl]methanol
CID 143970064

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one?
The IUPAC name of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one (CID 141051178) is 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one.
What is the SMILES notation for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one?
The canonical SMILES for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one is O=C1C=Cc2cc(-c3nc(-c4ccccc4)[nH]c3-c3ccncc3)ccc21.
What is the InChIKey of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one?
The InChIKey is RFXKEDTXEOLXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O/c27-20-9-7-17-14-18(6-8-19(17)20)22-21(15-10-12-24-13-11-15)25-23(26-22)16-4-2-1-3-5-16/h1-14H,(H,25,26).
What are the key properties of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one?
5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one has a molecular weight of 349.39 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)inden-1-one is sourced from PubChem (CID 141051178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).