3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

C10H14IN3 — CID 130056831

IUPAC3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESIc1nc(C2CCC2)n2c1CNCC2
InChIInChI=1S/C10H14IN3/c11-9-8-6-12-4-5-14(8)10(13-9)7-2-1-3-7/h7,12H,1-6H2
InChIKeyUBLNATXICXVKLR-UHFFFAOYSA-N
MW303.15 g/mol
LogP1.86
Rot. Bonds1

About 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine

3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (PubChem CID 130056831) has the molecular formula C10H14IN3 and a molecular weight of 303.15 g/mol. Its IUPAC name is 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
PubChem CID130056831
Molecular FormulaC10H14IN3
Molecular Weight303.15 g/mol
Exact Mass303.02
IUPAC Name3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine
SMILESIc1nc(C2CCC2)n2c1CNCC2
InChIInChI=1S/C10H14IN3/c11-9-8-6-12-4-5-14(8)10(13-9)7-2-1-3-7/h7,12H,1-6H2
InChIKeyUBLNATXICXVKLR-UHFFFAOYSA-N
XLogP1.86
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.15
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine 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 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The IUPAC name of 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine (CID 130056831) is 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine.
What is the SMILES notation for 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The canonical SMILES for 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is Ic1nc(C2CCC2)n2c1CNCC2.
What is the InChIKey of 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
The InChIKey is UBLNATXICXVKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14IN3/c11-9-8-6-12-4-5-14(8)10(13-9)7-2-1-3-7/h7,12H,1-6H2.
What are the key properties of 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine?
3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine has a molecular weight of 303.15 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1-iodo-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine is sourced from PubChem (CID 130056831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).