N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide

C18H18FN5O — CID 154788560

IUPACN-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CCN(c2nccn3cncc23)CC1
InChIInChI=1S/C18H18FN5O/c19-14-2-1-3-15(10-14)22-18(25)13-4-7-23(8-5-13)17-16-11-20-12-24(16)9-6-21-17/h1-3,6,9-13H,4-5,7-8H2,(H,22,25)
InChIKeyQEBYABIBARKXRN-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.72
Rot. Bonds3

About N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide

N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide (PubChem CID 154788560) has the molecular formula C18H18FN5O and a molecular weight of 339.37 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide
PubChem CID154788560
Molecular FormulaC18H18FN5O
Molecular Weight339.37 g/mol
Exact Mass339.15
IUPAC NameN-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CCN(c2nccn3cncc23)CC1
InChIInChI=1S/C18H18FN5O/c19-14-2-1-3-15(10-14)22-18(25)13-4-7-23(8-5-13)17-16-11-20-12-24(16)9-6-21-17/h1-3,6,9-13H,4-5,7-8H2,(H,22,25)
InChIKeyQEBYABIBARKXRN-UHFFFAOYSA-N
XLogP2.72
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide (CID 154788560) is N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide is O=C(Nc1cccc(F)c1)C1CCN(c2nccn3cncc23)CC1.
What is the InChIKey of N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide?
The InChIKey is QEBYABIBARKXRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN5O/c19-14-2-1-3-15(10-14)22-18(25)13-4-7-23(8-5-13)17-16-11-20-12-24(16)9-6-21-17/h1-3,6,9-13H,4-5,7-8H2,(H,22,25).
What are the key properties of N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide?
N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide has a molecular weight of 339.37 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1-imidazo[1,5-a]pyrazin-8-ylpiperidine-4-carboxamide is sourced from PubChem (CID 154788560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).