7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one

C17H23N3O — CID 122652224

IUPAC7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one
SMILESO=c1c2cnc(C3CC3)n2ccn1CC1CCCCCC1
InChIInChI=1S/C17H23N3O/c21-17-15-11-18-16(14-7-8-14)20(15)10-9-19(17)12-13-5-3-1-2-4-6-13/h9-11,13-14H,1-8,12H2
InChIKeyYIBKFYWXALCNMI-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.34
Rot. Bonds3

About 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one

7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one (PubChem CID 122652224) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one
PubChem CID122652224
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one
SMILESO=c1c2cnc(C3CC3)n2ccn1CC1CCCCCC1
InChIInChI=1S/C17H23N3O/c21-17-15-11-18-16(14-7-8-14)20(15)10-9-19(17)12-13-5-3-1-2-4-6-13/h9-11,13-14H,1-8,12H2
InChIKeyYIBKFYWXALCNMI-UHFFFAOYSA-N
XLogP3.34
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one (CID 122652224) is 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one is O=c1c2cnc(C3CC3)n2ccn1CC1CCCCCC1.
What is the InChIKey of 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one?
The InChIKey is YIBKFYWXALCNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c21-17-15-11-18-16(14-7-8-14)20(15)10-9-19(17)12-13-5-3-1-2-4-6-13/h9-11,13-14H,1-8,12H2.
What are the key properties of 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one?
7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one has a molecular weight of 285.39 g/mol, XLogP of 3.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cycloheptylmethyl)-3-cyclopropylimidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 122652224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).