1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone

C13H20N4O4S — CID 131693815

IUPAC1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
SMILESCCCS(=O)(=O)N1Cc2cncn2C(C(=O)N2CCCO2)C1
InChIInChI=1S/C13H20N4O4S/c1-2-6-22(19,20)15-8-11-7-14-10-16(11)12(9-15)13(18)17-4-3-5-21-17/h7,10,12H,2-6,8-9H2,1H3
InChIKeyRYZZXPDKQBOOFM-UHFFFAOYSA-N
MW328.39 g/mol
LogP0.14
Rot. Bonds4

About 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone

1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone (PubChem CID 131693815) has the molecular formula C13H20N4O4S and a molecular weight of 328.39 g/mol. Its IUPAC name is 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone.

Molecular Properties

Compound Name1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
PubChem CID131693815
Molecular FormulaC13H20N4O4S
Molecular Weight328.39 g/mol
Exact Mass328.12
IUPAC Name1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone
SMILESCCCS(=O)(=O)N1Cc2cncn2C(C(=O)N2CCCO2)C1
InChIInChI=1S/C13H20N4O4S/c1-2-6-22(19,20)15-8-11-7-14-10-16(11)12(9-15)13(18)17-4-3-5-21-17/h7,10,12H,2-6,8-9H2,1H3
InChIKeyRYZZXPDKQBOOFM-UHFFFAOYSA-N
XLogP0.14
TPSA84.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The IUPAC name of 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone (CID 131693815) is 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone.
What is the SMILES notation for 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The canonical SMILES for 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone is CCCS(=O)(=O)N1Cc2cncn2C(C(=O)N2CCCO2)C1.
What is the InChIKey of 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
The InChIKey is RYZZXPDKQBOOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O4S/c1-2-6-22(19,20)15-8-11-7-14-10-16(11)12(9-15)13(18)17-4-3-5-21-17/h7,10,12H,2-6,8-9H2,1H3.
What are the key properties of 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone?
1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone has a molecular weight of 328.39 g/mol, XLogP of 0.14, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazolidin-2-yl-(7-propylsulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-5-yl)methanone is sourced from PubChem (CID 131693815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).