1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine

C28H22N4 — CID 132506858

IUPAC1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine
SMILESc1ccc(-c2nc(CCc3nc(-c4ccccc4)c4ccccn34)n3ccccc23)cc1
InChIInChI=1S/C28H22N4/c1-3-11-21(12-4-1)27-23-15-7-9-19-31(23)25(29-27)17-18-26-30-28(22-13-5-2-6-14-22)24-16-8-10-20-32(24)26/h1-16,19-20H,17-18H2
InChIKeyRMIMTWPQEVLTFK-UHFFFAOYSA-N
MW414.51 g/mol
LogP6.10
Rot. Bonds5

About 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine

1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine (PubChem CID 132506858) has the molecular formula C28H22N4 and a molecular weight of 414.51 g/mol. Its IUPAC name is 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine
PubChem CID132506858
Molecular FormulaC28H22N4
Molecular Weight414.51 g/mol
Exact Mass414.18
IUPAC Name1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine
SMILESc1ccc(-c2nc(CCc3nc(-c4ccccc4)c4ccccn34)n3ccccc23)cc1
InChIInChI=1S/C28H22N4/c1-3-11-21(12-4-1)27-23-15-7-9-19-31(23)25(29-27)17-18-26-30-28(22-13-5-2-6-14-22)24-16-8-10-20-32(24)26/h1-16,19-20H,17-18H2
InChIKeyRMIMTWPQEVLTFK-UHFFFAOYSA-N
XLogP6.10
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.51
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3,5-bis(1-phenylimidazo[1,5-a]pyridin-3-yl)phenyl]-1-phenylimidazo[1,5-a]pyridine
CID 132506865
1-phenylimidazo[1,5-a]pyridine-3-carbaldehyde
CID 112757352
1-phenyl-3-phenylsulfanylimidazo[1,5-a]pyridine
CID 169101709
1-(4-methylphenyl)-3-[1-(4-methylphenyl)imidazo[1,5-a]pyridin-3-yl]imidazo[1,5-a]pyridine
CID 132965985
3-(2-fluorophenyl)-1-phenylimidazo[1,5-a]pyridine
CID 132581650
3-(furan-2-yl)-1-phenylimidazo[1,5-a]pyridine
CID 728608
7-methyl-4-phenylpyrrolo[1,2-a]quinoxaline
CID 132523762
2,2,2-trifluoro-N-[2-[1-(4-methoxyphenyl)imidazo[1,5-a]pyridin-3-yl]ethyl]acetamide
CID 119056741
3-(3,5-dinaphthalen-2-ylphenyl)-1-phenylimidazo[1,5-a]pyridine
CID 129257002
tert-butyl N-[2-[1-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-3-yl]ethyl]carbamate
CID 11742008
3-[(E)-2-(4-chlorophenyl)ethenyl]-1-phenylimidazo[1,5-a]pyridine
CID 6006165
3-(2-chloroethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984026

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine?
The IUPAC name of 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine (CID 132506858) is 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine?
The canonical SMILES for 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine is c1ccc(-c2nc(CCc3nc(-c4ccccc4)c4ccccn34)n3ccccc23)cc1.
What is the InChIKey of 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine?
The InChIKey is RMIMTWPQEVLTFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22N4/c1-3-11-21(12-4-1)27-23-15-7-9-19-31(23)25(29-27)17-18-26-30-28(22-13-5-2-6-14-22)24-16-8-10-20-32(24)26/h1-16,19-20H,17-18H2.
What are the key properties of 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine?
1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine has a molecular weight of 414.51 g/mol, XLogP of 6.10, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 132506858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).