5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide

C11H16N6O — CID 106241738

IUPAC5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide
SMILESNC(=O)CCCCNc1nc(N)cn2ccnc12
InChIInChI=1S/C11H16N6O/c12-8-7-17-6-5-15-11(17)10(16-8)14-4-2-1-3-9(13)18/h5-7H,1-4,12H2,(H2,13,18)(H,14,16)
InChIKeyZNCVZCDKJVFDJW-UHFFFAOYSA-N
MW248.29 g/mol
LogP0.38
Rot. Bonds6

About 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide

5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide (PubChem CID 106241738) has the molecular formula C11H16N6O and a molecular weight of 248.29 g/mol. Its IUPAC name is 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide.

Molecular Properties

Compound Name5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide
PubChem CID106241738
Molecular FormulaC11H16N6O
Molecular Weight248.29 g/mol
Exact Mass248.14
IUPAC Name5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide
SMILESNC(=O)CCCCNc1nc(N)cn2ccnc12
InChIInChI=1S/C11H16N6O/c12-8-7-17-6-5-15-11(17)10(16-8)14-4-2-1-3-9(13)18/h5-7H,1-4,12H2,(H2,13,18)(H,14,16)
InChIKeyZNCVZCDKJVFDJW-UHFFFAOYSA-N
XLogP0.38
TPSA111.33 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide?
The IUPAC name of 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide (CID 106241738) is 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide.
What is the SMILES notation for 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide?
The canonical SMILES for 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide is NC(=O)CCCCNc1nc(N)cn2ccnc12.
What is the InChIKey of 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide?
The InChIKey is ZNCVZCDKJVFDJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O/c12-8-7-17-6-5-15-11(17)10(16-8)14-4-2-1-3-9(13)18/h5-7H,1-4,12H2,(H2,13,18)(H,14,16).
What are the key properties of 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide?
5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide has a molecular weight of 248.29 g/mol, XLogP of 0.38, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]pentanamide is sourced from PubChem (CID 106241738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).