3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile

C14H12N6O — CID 107662875

IUPAC3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile
SMILESCc1ccc(C#N)cc1Oc1nc(NN)cn2ccnc12
InChIInChI=1S/C14H12N6O/c1-9-2-3-10(7-15)6-11(9)21-14-13-17-4-5-20(13)8-12(18-14)19-16/h2-6,8,19H,16H2,1H3
InChIKeyDMRWQQYNDQUAOC-UHFFFAOYSA-N
MW280.29 g/mol
LogP1.99
Rot. Bonds3

About 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile

3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile (PubChem CID 107662875) has the molecular formula C14H12N6O and a molecular weight of 280.29 g/mol. Its IUPAC name is 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile.

Molecular Properties

Compound Name3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile
PubChem CID107662875
Molecular FormulaC14H12N6O
Molecular Weight280.29 g/mol
Exact Mass280.11
IUPAC Name3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile
SMILESCc1ccc(C#N)cc1Oc1nc(NN)cn2ccnc12
InChIInChI=1S/C14H12N6O/c1-9-2-3-10(7-15)6-11(9)21-14-13-17-4-5-20(13)8-12(18-14)19-16/h2-6,8,19H,16H2,1H3
InChIKeyDMRWQQYNDQUAOC-UHFFFAOYSA-N
XLogP1.99
TPSA101.26 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 51.99
H-Bond Donors ≤ 52
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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Related Compounds

[8-(2-methoxy-4-methylphenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80909010
[8-(2,4,5-trichlorophenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80909574
[8-(2,4-dichlorophenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80915231
[8-(3-methoxyphenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80915169
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-4-methylbenzonitrile
CID 107662868
(8-phenoxyimidazo[1,2-a]pyrazin-6-yl)hydrazine
CID 80915464
2-[4-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]acetonitrile
CID 80911184
[8-(3,4-difluorophenoxy)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80921172
8-(5-fluoro-2-methylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 102989110
8-(2-methyl-5-propan-2-ylphenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80875088
8-(2-methyl-5-nitrophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80878888
4-methyl-3-pyrimidin-2-yloxybenzonitrile
CID 70098309

Frequently Asked Questions

What is the IUPAC name of 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile?
The IUPAC name of 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile (CID 107662875) is 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile.
What is the SMILES notation for 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile?
The canonical SMILES for 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile is Cc1ccc(C#N)cc1Oc1nc(NN)cn2ccnc12.
What is the InChIKey of 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile?
The InChIKey is DMRWQQYNDQUAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N6O/c1-9-2-3-10(7-15)6-11(9)21-14-13-17-4-5-20(13)8-12(18-14)19-16/h2-6,8,19H,16H2,1H3.
What are the key properties of 3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile?
3-(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)oxy-4-methylbenzonitrile has a molecular weight of 280.29 g/mol, XLogP of 1.99, 3 rotatable bonds, 2 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)oxy-4-methylbenzonitrile is sourced from PubChem (CID 107662875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).