N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide

C21H25N3O — CID 70943994

IUPACN-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1nc(C2CC2)n2ccccc12
InChIInChI=1S/C21H25N3O/c25-20(23-21-10-13-7-14(11-21)9-15(8-13)12-21)18-17-3-1-2-6-24(17)19(22-18)16-4-5-16/h1-3,6,13-16H,4-5,7-12H2,(H,23,25)
InChIKeyXXXVUPREGXUDTE-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.91
Rot. Bonds3

About N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide

N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 70943994) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID70943994
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC NameN-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1nc(C2CC2)n2ccccc12
InChIInChI=1S/C21H25N3O/c25-20(23-21-10-13-7-14(11-21)9-15(8-13)12-21)18-17-3-1-2-6-24(17)19(22-18)16-4-5-16/h1-3,6,13-16H,4-5,7-12H2,(H,23,25)
InChIKeyXXXVUPREGXUDTE-UHFFFAOYSA-N
XLogP3.91
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide 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 N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide (CID 70943994) is N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide is O=C(NC12CC3CC(CC(C3)C1)C2)c1nc(C2CC2)n2ccccc12.
What is the InChIKey of N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is XXXVUPREGXUDTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c25-20(23-21-10-13-7-14(11-21)9-15(8-13)12-21)18-17-3-1-2-6-24(17)19(22-18)16-4-5-16/h1-3,6,13-16H,4-5,7-12H2,(H,23,25).
What are the key properties of N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide?
N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-3-cyclopropylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 70943994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).