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

C10H14N6O2 — CID 80899293

IUPACmethyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate
SMILESCOC(=O)CCNc1nc(NN)cn2ccnc12
InChIInChI=1S/C10H14N6O2/c1-18-8(17)2-3-12-9-10-13-4-5-16(10)6-7(14-9)15-11/h4-6,15H,2-3,11H2,1H3,(H,12,14)
InChIKeyZTWCMBBWEMJTLO-UHFFFAOYSA-N
MW250.26 g/mol
LogP-0.01
Rot. Bonds5

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

methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate (PubChem CID 80899293) has the molecular formula C10H14N6O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate.

Molecular Properties

Compound Namemethyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate
PubChem CID80899293
Molecular FormulaC10H14N6O2
Molecular Weight250.26 g/mol
Exact Mass250.12
IUPAC Namemethyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate
SMILESCOC(=O)CCNc1nc(NN)cn2ccnc12
InChIInChI=1S/C10H14N6O2/c1-18-8(17)2-3-12-9-10-13-4-5-16(10)6-7(14-9)15-11/h4-6,15H,2-3,11H2,1H3,(H,12,14)
InChIKeyZTWCMBBWEMJTLO-UHFFFAOYSA-N
XLogP-0.01
TPSA106.57 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

ethyl 3-[[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]amino]propanoate
CID 80816137
ethyl 2-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]acetate
CID 80898117
6-hydrazinyl-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine
CID 80933012
N-butyl-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80931834
5-[[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]amino]pentanamide
CID 106241711
N-tert-butyl-2-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]acetamide
CID 115357489
N-(2,2-dimethylpropyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80899650
methyl 2-[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]acetate
CID 80777733
3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutanamide
CID 114143250
6-hydrazinyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyrazin-8-amine
CID 80902450
2-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]-2-methylpropan-1-ol
CID 80907261
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]propanamide
CID 79958127

Frequently Asked Questions

What is the IUPAC name of methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate?
The IUPAC name of methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate (CID 80899293) is methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate.
What is the SMILES notation for methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate?
The canonical SMILES for methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate is COC(=O)CCNc1nc(NN)cn2ccnc12.
What is the InChIKey of methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate?
The InChIKey is ZTWCMBBWEMJTLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O2/c1-18-8(17)2-3-12-9-10-13-4-5-16(10)6-7(14-9)15-11/h4-6,15H,2-3,11H2,1H3,(H,12,14).
What are the key properties of methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate?
methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate has a molecular weight of 250.26 g/mol, XLogP of -0.01, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)amino]propanoate is sourced from PubChem (CID 80899293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).