8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine

C25H23FN2 — CID 134847912

IUPAC8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
SMILESCC(C)(C)/C=C(\c1ccccc1)c1cccn2c(-c3ccc(F)cc3)ncc12
InChIInChI=1S/C25H23FN2/c1-25(2,3)16-22(18-8-5-4-6-9-18)21-10-7-15-28-23(21)17-27-24(28)19-11-13-20(26)14-12-19/h4-17H,1-3H3/b22-16+
InChIKeyOECVQHUKIPYEDI-CJLVFECKSA-N
MW370.47 g/mol
LogP6.62
Rot. Bonds3

About 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine

8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine (PubChem CID 134847912) has the molecular formula C25H23FN2 and a molecular weight of 370.47 g/mol. Its IUPAC name is 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
PubChem CID134847912
Molecular FormulaC25H23FN2
Molecular Weight370.47 g/mol
Exact Mass370.18
IUPAC Name8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
SMILESCC(C)(C)/C=C(\c1ccccc1)c1cccn2c(-c3ccc(F)cc3)ncc12
InChIInChI=1S/C25H23FN2/c1-25(2,3)16-22(18-8-5-4-6-9-18)21-10-7-15-28-23(21)17-27-24(28)19-11-13-20(26)14-12-19/h4-17H,1-3H3/b22-16+
InChIKeyOECVQHUKIPYEDI-CJLVFECKSA-N
XLogP6.62
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.47
LogP ≤ 56.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-methylphenyl)imidazo[1,5-a]pyridine
CID 132597677
8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-methoxyphenyl)imidazo[1,5-a]pyridine
CID 132597671
3-(4-chlorophenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 84738796
4-(8-chloroimidazo[1,5-a]pyridin-3-yl)benzoic acid
CID 117158606
3-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]imidazo[1,5-a]pyridine-8-carboxamide
CID 52935852
4-(8-methylimidazo[1,5-a]pyridin-3-yl)phenol
CID 137006648
3-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]imidazo[1,5-a]pyridine-8-carboxamide
CID 52935857
(2-bromo-4-pyridinyl)methanamine;N-[(2-bromo-4-pyridinyl)methyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine-8-carboxamide;deuterio(fluoro)methane;3-(4-fluorophenyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 161371376
4-(8-aminoimidazo[1,5-a]pyridin-3-yl)phenol
CID 137006649
8-chloro-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridine
CID 117147210
ethane;3-(4-fluorophenyl)-8-methoxy-6-methylimidazo[1,5-a]pyrazine
CID 145438174
1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
CID 117250849

Frequently Asked Questions

What is the IUPAC name of 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine?
The IUPAC name of 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine (CID 134847912) is 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine is CC(C)(C)/C=C(\c1ccccc1)c1cccn2c(-c3ccc(F)cc3)ncc12.
What is the InChIKey of 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine?
The InChIKey is OECVQHUKIPYEDI-CJLVFECKSA-N. The full InChI is InChI=1S/C25H23FN2/c1-25(2,3)16-22(18-8-5-4-6-9-18)21-10-7-15-28-23(21)17-27-24(28)19-11-13-20(26)14-12-19/h4-17H,1-3H3/b22-16+.
What are the key properties of 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine?
8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine has a molecular weight of 370.47 g/mol, XLogP of 6.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(E)-3,3-dimethyl-1-phenylbut-1-enyl]-3-(4-fluorophenyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 134847912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).