7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one

C19H27N3O2 — CID 122652213

IUPAC7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
SMILESCc1cn2c(C3CCOCC3)ncc2c(=O)n1CC1CCCCC1
InChIInChI=1S/C19H27N3O2/c1-14-12-22-17(11-20-18(22)16-7-9-24-10-8-16)19(23)21(14)13-15-5-3-2-4-6-15/h11-12,15-16H,2-10,13H2,1H3
InChIKeyXQZACXVVNPRUIZ-UHFFFAOYSA-N
MW329.44 g/mol
LogP3.28
Rot. Bonds3

About 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one

7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one (PubChem CID 122652213) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one.

Molecular Properties

Compound Name7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
PubChem CID122652213
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one
SMILESCc1cn2c(C3CCOCC3)ncc2c(=O)n1CC1CCCCC1
InChIInChI=1S/C19H27N3O2/c1-14-12-22-17(11-20-18(22)16-7-9-24-10-8-16)19(23)21(14)13-15-5-3-2-4-6-15/h11-12,15-16H,2-10,13H2,1H3
InChIKeyXQZACXVVNPRUIZ-UHFFFAOYSA-N
XLogP3.28
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Methyl-7-(oxan-4-yl)-2-[[4-(trifluoromethyl)cyclohexyl]methoxy]imidazo[5,1-f][1,2,4]triazin-4-one
CID 122540493
US10858362, Example 13
CID 122652224
US10858362, Example 66--trans
CID 122652228
US10858362, Example 67
CID 122652247
US10858362, Example 12
CID 122652262
US10858362, Example 7
CID 122652273
US10858362, Example 62
CID 122652305
US10858362, Example 8
CID 122652314
US10858362, Example 65
CID 122652324
US10858362, Example 63
CID 122652331
US10858362, Example 11
CID 122652369
US10858362, Example 10
CID 122652379

Frequently Asked Questions

What is the IUPAC name of 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The IUPAC name of 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one (CID 122652213) is 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one.
What is the SMILES notation for 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The canonical SMILES for 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one is Cc1cn2c(C3CCOCC3)ncc2c(=O)n1CC1CCCCC1.
What is the InChIKey of 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
The InChIKey is XQZACXVVNPRUIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-14-12-22-17(11-20-18(22)16-7-9-24-10-8-16)19(23)21(14)13-15-5-3-2-4-6-15/h11-12,15-16H,2-10,13H2,1H3.
What are the key properties of 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one?
7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one has a molecular weight of 329.44 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclohexylmethyl)-6-methyl-3-(oxan-4-yl)imidazo[1,5-a]pyrazin-8-one is sourced from PubChem (CID 122652213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).