3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide

C11H17N7O — CID 114143250

IUPAC3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide
SMILESCC(C)(CC(N)=O)Nc1nc(NN)cn2ccnc12
InChIInChI=1S/C11H17N7O/c1-11(2,5-7(12)19)16-9-10-14-3-4-18(10)6-8(15-9)17-13/h3-4,6,17H,5,13H2,1-2H3,(H2,12,19)(H,15,16)
InChIKeyAODQECMWQMPQQF-UHFFFAOYSA-N
MW263.31 g/mol
LogP0.08
Rot. Bonds5

About 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide

3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide (PubChem CID 114143250) has the molecular formula C11H17N7O and a molecular weight of 263.31 g/mol. Its IUPAC name is 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide.

Molecular Properties

Compound Name3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide
PubChem CID114143250
Molecular FormulaC11H17N7O
Molecular Weight263.31 g/mol
Exact Mass263.15
IUPAC Name3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide
SMILESCC(C)(CC(N)=O)Nc1nc(NN)cn2ccnc12
InChIInChI=1S/C11H17N7O/c1-11(2,5-7(12)19)16-9-10-14-3-4-18(10)6-8(15-9)17-13/h3-4,6,17H,5,13H2,1-2H3,(H2,12,19)(H,15,16)
InChIKeyAODQECMWQMPQQF-UHFFFAOYSA-N
XLogP0.08
TPSA123.36 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 50.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide?
The IUPAC name of 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide (CID 114143250) is 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide.
What is the SMILES notation for 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide?
The canonical SMILES for 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide is CC(C)(CC(N)=O)Nc1nc(NN)cn2ccnc12.
What is the InChIKey of 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide?
The InChIKey is AODQECMWQMPQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7O/c1-11(2,5-7(12)19)16-9-10-14-3-4-18(10)6-8(15-9)17-13/h3-4,6,17H,5,13H2,1-2H3,(H2,12,19)(H,15,16).
What are the key properties of 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide?
3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide has a molecular weight of 263.31 g/mol, XLogP of 0.08, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide is sourced from PubChem (CID 114143250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).