5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one

C23H24FN3O2 — CID 68653145

IUPAC5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
SMILESCCC1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21
InChIInChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3
InChIKeyVOGMHYROBPFMJD-UHFFFAOYSA-N
MW393.46 g/mol
LogP4.04
Rot. Bonds5

About 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one

5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one (PubChem CID 68653145) has the molecular formula C23H24FN3O2 and a molecular weight of 393.46 g/mol. Its IUPAC name is 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
PubChem CID68653145
Molecular FormulaC23H24FN3O2
Molecular Weight393.46 g/mol
Exact Mass393.19
IUPAC Name5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
SMILESCCC1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21
InChIInChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3
InChIKeyVOGMHYROBPFMJD-UHFFFAOYSA-N
XLogP4.04
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.46
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The IUPAC name of 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one (CID 68653145) is 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one is CCC1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21.
What is the InChIKey of 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The InChIKey is VOGMHYROBPFMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3.
What are the key properties of 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one has a molecular weight of 393.46 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 68653145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).