N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide

C15H16F3N5O — CID 138054151

IUPACN-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
SMILESCc1cc(NC(=O)N2CCn3c(cnc3C(F)(F)F)C2)cc(C)n1
InChIInChI=1S/C15H16F3N5O/c1-9-5-11(6-10(2)20-9)21-14(24)22-3-4-23-12(8-22)7-19-13(23)15(16,17)18/h5-7H,3-4,8H2,1-2H3,(H,20,21,24)
InChIKeyWZMBXRXZEFRKST-UHFFFAOYSA-N
MW339.32 g/mol
LogP2.96
Rot. Bonds1

About N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide

N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide (PubChem CID 138054151) has the molecular formula C15H16F3N5O and a molecular weight of 339.32 g/mol. Its IUPAC name is N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
PubChem CID138054151
Molecular FormulaC15H16F3N5O
Molecular Weight339.32 g/mol
Exact Mass339.13
IUPAC NameN-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
SMILESCc1cc(NC(=O)N2CCn3c(cnc3C(F)(F)F)C2)cc(C)n1
InChIInChI=1S/C15H16F3N5O/c1-9-5-11(6-10(2)20-9)21-14(24)22-3-4-23-12(8-22)7-19-13(23)15(16,17)18/h5-7H,3-4,8H2,1-2H3,(H,20,21,24)
InChIKeyWZMBXRXZEFRKST-UHFFFAOYSA-N
XLogP2.96
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.32
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide?
The IUPAC name of N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide (CID 138054151) is N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide.
What is the SMILES notation for N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide?
The canonical SMILES for N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide is Cc1cc(NC(=O)N2CCn3c(cnc3C(F)(F)F)C2)cc(C)n1.
What is the InChIKey of N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide?
The InChIKey is WZMBXRXZEFRKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N5O/c1-9-5-11(6-10(2)20-9)21-14(24)22-3-4-23-12(8-22)7-19-13(23)15(16,17)18/h5-7H,3-4,8H2,1-2H3,(H,20,21,24).
What are the key properties of N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide?
N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide has a molecular weight of 339.32 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethyl-4-pyridinyl)-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide is sourced from PubChem (CID 138054151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).