N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide

C24H24FN3O — CID 69005872

IUPACN-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1nc(-c2ccccc2F)c2ccccn12
InChIInChI=1S/C24H24FN3O/c25-19-6-2-1-5-18(19)21-20-7-3-4-8-28(20)22(26-21)23(29)27-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-8,15-17H,9-14H2,(H,27,29)
InChIKeyLBAHRRQINLVGMO-UHFFFAOYSA-N
MW389.47 g/mol
LogP4.84
Rot. Bonds3

About N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide

N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 69005872) has the molecular formula C24H24FN3O and a molecular weight of 389.47 g/mol. Its IUPAC name is N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID69005872
Molecular FormulaC24H24FN3O
Molecular Weight389.47 g/mol
Exact Mass389.19
IUPAC NameN-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NC12CC3CC(CC(C3)C1)C2)c1nc(-c2ccccc2F)c2ccccn12
InChIInChI=1S/C24H24FN3O/c25-19-6-2-1-5-18(19)21-20-7-3-4-8-28(20)22(26-21)23(29)27-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-8,15-17H,9-14H2,(H,27,29)
InChIKeyLBAHRRQINLVGMO-UHFFFAOYSA-N
XLogP4.84
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.47
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide (CID 69005872) is N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide is O=C(NC12CC3CC(CC(C3)C1)C2)c1nc(-c2ccccc2F)c2ccccn12.
What is the InChIKey of N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is LBAHRRQINLVGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O/c25-19-6-2-1-5-18(19)21-20-7-3-4-8-28(20)22(26-21)23(29)27-24-12-15-9-16(13-24)11-17(10-15)14-24/h1-8,15-17H,9-14H2,(H,27,29).
What are the key properties of N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide?
N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 389.47 g/mol, XLogP of 4.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-1-(2-fluorophenyl)imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 69005872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).