6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone

C12H14N6O — CID 81255607

IUPAC6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone
SMILESNNc1ccncc1C(=O)N1CCn2ccnc2C1
InChIInChI=1S/C12H14N6O/c13-16-10-1-2-14-7-9(10)12(19)18-6-5-17-4-3-15-11(17)8-18/h1-4,7H,5-6,8,13H2,(H,14,16)
InChIKeyRXSYVQBWKSALDW-UHFFFAOYSA-N
MW258.28 g/mol
LogP0.22
Rot. Bonds2

About 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone (PubChem CID 81255607) has the molecular formula C12H14N6O and a molecular weight of 258.28 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone
PubChem CID81255607
Molecular FormulaC12H14N6O
Molecular Weight258.28 g/mol
Exact Mass258.12
IUPAC Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone
SMILESNNc1ccncc1C(=O)N1CCn2ccnc2C1
InChIInChI=1S/C12H14N6O/c13-16-10-1-2-14-7-9(10)12(19)18-6-5-17-4-3-15-11(17)8-18/h1-4,7H,5-6,8,13H2,(H,14,16)
InChIKeyRXSYVQBWKSALDW-UHFFFAOYSA-N
XLogP0.22
TPSA89.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone?
The IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone (CID 81255607) is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone?
The canonical SMILES for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone is NNc1ccncc1C(=O)N1CCn2ccnc2C1.
What is the InChIKey of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone?
The InChIKey is RXSYVQBWKSALDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O/c13-16-10-1-2-14-7-9(10)12(19)18-6-5-17-4-3-15-11(17)8-18/h1-4,7H,5-6,8,13H2,(H,14,16).
What are the key properties of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone?
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone has a molecular weight of 258.28 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone is sourced from PubChem (CID 81255607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).