1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine

C27H29N3O — CID 11223645

IUPAC1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine
SMILESCOc1ccc(-c2nc(C3CCN(CCc4ccccc4)CC3)n3ccccc23)cc1
InChIInChI=1S/C27H29N3O/c1-31-24-12-10-22(11-13-24)26-25-9-5-6-17-30(25)27(28-26)23-15-19-29(20-16-23)18-14-21-7-3-2-4-8-21/h2-13,17,23H,14-16,18-20H2,1H3
InChIKeyARZRNMOXMFFEBD-UHFFFAOYSA-N
MW411.55 g/mol
LogP5.43
Rot. Bonds6

About 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine

1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine (PubChem CID 11223645) has the molecular formula C27H29N3O and a molecular weight of 411.55 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine
PubChem CID11223645
Molecular FormulaC27H29N3O
Molecular Weight411.55 g/mol
Exact Mass411.23
IUPAC Name1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine
SMILESCOc1ccc(-c2nc(C3CCN(CCc4ccccc4)CC3)n3ccccc23)cc1
InChIInChI=1S/C27H29N3O/c1-31-24-12-10-22(11-13-24)26-25-9-5-6-17-30(25)27(28-26)23-15-19-29(20-16-23)18-14-21-7-3-2-4-8-21/h2-13,17,23H,14-16,18-20H2,1H3
InChIKeyARZRNMOXMFFEBD-UHFFFAOYSA-N
XLogP5.43
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.55
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]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

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine?
The IUPAC name of 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine (CID 11223645) is 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine.
What is the SMILES notation for 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine?
The canonical SMILES for 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine is COc1ccc(-c2nc(C3CCN(CCc4ccccc4)CC3)n3ccccc23)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine?
The InChIKey is ARZRNMOXMFFEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N3O/c1-31-24-12-10-22(11-13-24)26-25-9-5-6-17-30(25)27(28-26)23-15-19-29(20-16-23)18-14-21-7-3-2-4-8-21/h2-13,17,23H,14-16,18-20H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine?
1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine has a molecular weight of 411.55 g/mol, XLogP of 5.43, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-3-[1-(2-phenylethyl)piperidin-4-yl]imidazo[1,5-a]pyridine is sourced from PubChem (CID 11223645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).