3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine

C25H15FN2 — CID 53469685

IUPAC3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine
SMILESFc1ccc(-c2nc(C#Cc3cccc4ccccc34)c3ccccn23)cc1
InChIInChI=1S/C25H15FN2/c26-21-14-11-20(12-15-21)25-27-23(24-10-3-4-17-28(24)25)16-13-19-8-5-7-18-6-1-2-9-22(18)19/h1-12,14-15,17H
InChIKeyFFOIEWVKTANFCT-UHFFFAOYSA-N
MW362.41 g/mol
LogP5.69
Rot. Bonds1

About 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine

3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine (PubChem CID 53469685) has the molecular formula C25H15FN2 and a molecular weight of 362.41 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine
PubChem CID53469685
Molecular FormulaC25H15FN2
Molecular Weight362.41 g/mol
Exact Mass362.12
IUPAC Name3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine
SMILESFc1ccc(-c2nc(C#Cc3cccc4ccccc34)c3ccccn23)cc1
InChIInChI=1S/C25H15FN2/c26-21-14-11-20(12-15-21)25-27-23(24-10-3-4-17-28(24)25)16-13-19-8-5-7-18-6-1-2-9-22(18)19/h1-12,14-15,17H
InChIKeyFFOIEWVKTANFCT-UHFFFAOYSA-N
XLogP5.69
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.41
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
CID 117250849
1-ethynyl-3-phenylimidazo[1,5-a]pyridine
CID 53468720
1-[3-(4-fluorophenyl)imidazo[1,5-a]pyridin-1-yl]-N-methylmethanamine
CID 28797067
3-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 70943829
2-[3-(4-methoxyphenyl)imidazo[1,5-a]pyridin-1-yl]ethynyl-trimethylsilane
CID 53469313
3-phenyl-1-[(3-phenylimidazo[1,5-a]pyridin-1-yl)diselanyl]imidazo[1,5-a]pyridine
CID 102267342
1-[2-(3-fluorophenyl)ethynyl]naphthalene
CID 171990074
2,3,6,7-tetrakis(2-naphthalen-1-ylethynyl)naphthalene
CID 177465758
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 28752075
3-(4-fluorophenyl)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 173128485
N-(dicyclopropylmethyl)-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 70943821
potassium trifluoro(2-naphthalen-1-ylethynyl)boranuide
CID 135083871

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine (CID 53469685) is 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine is Fc1ccc(-c2nc(C#Cc3cccc4ccccc34)c3ccccn23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine?
The InChIKey is FFOIEWVKTANFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H15FN2/c26-21-14-11-20(12-15-21)25-27-23(24-10-3-4-17-28(24)25)16-13-19-8-5-7-18-6-1-2-9-22(18)19/h1-12,14-15,17H.
What are the key properties of 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine?
3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine has a molecular weight of 362.41 g/mol, XLogP of 5.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1-(2-naphthalen-1-ylethynyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 53469685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).