5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one

C21H27N3O2Si — CID 137330678

IUPAC5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one
SMILESCC[SiH](C)c1ccc(OC2CCCC2)c(-c2cn(C)c(=O)c3cncn23)c1
InChIInChI=1S/C21H27N3O2Si/c1-4-27(3)16-9-10-20(26-15-7-5-6-8-15)17(11-16)19-13-23(2)21(25)18-12-22-14-24(18)19/h9-15,27H,4-8H2,1-3H3
InChIKeyOGDSROJNLAEBAD-UHFFFAOYSA-N
MW381.55 g/mol
LogP3.11
Rot. Bonds5

About 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one

5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one (PubChem CID 137330678) has the molecular formula C21H27N3O2Si and a molecular weight of 381.55 g/mol. Its IUPAC name is 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one
PubChem CID137330678
Molecular FormulaC21H27N3O2Si
Molecular Weight381.55 g/mol
Exact Mass381.19
IUPAC Name5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one
SMILESCC[SiH](C)c1ccc(OC2CCCC2)c(-c2cn(C)c(=O)c3cncn23)c1
InChIInChI=1S/C21H27N3O2Si/c1-4-27(3)16-9-10-20(26-15-7-5-6-8-15)17(11-16)19-13-23(2)21(25)18-12-22-14-24(18)19/h9-15,27H,4-8H2,1-3H3
InChIKeyOGDSROJNLAEBAD-UHFFFAOYSA-N
XLogP3.11
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.55
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one (CID 137330678) is 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one is CC[SiH](C)c1ccc(OC2CCCC2)c(-c2cn(C)c(=O)c3cncn23)c1.
What is the InChIKey of 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one?
The InChIKey is OGDSROJNLAEBAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2Si/c1-4-27(3)16-9-10-20(26-15-7-5-6-8-15)17(11-16)19-13-23(2)21(25)18-12-22-14-24(18)19/h9-15,27H,4-8H2,1-3H3.
What are the key properties of 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one?
5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one has a molecular weight of 381.55 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-cyclopentyloxy-5-[ethyl(methyl)silyl]phenyl]-7-methylimidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 137330678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).