N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine

C13H13ClN6O — CID 107623718

IUPACN-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
SMILESCOc1cc(Nc2nc(NN)cn3ccnc23)ccc1Cl
InChIInChI=1S/C13H13ClN6O/c1-21-10-6-8(2-3-9(10)14)17-12-13-16-4-5-20(13)7-11(18-12)19-15/h2-7,19H,15H2,1H3,(H,17,18)
InChIKeyIOWYICWQKOHFIW-UHFFFAOYSA-N
MW304.74 g/mol
LogP2.42
Rot. Bonds4

About N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine

N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 107623718) has the molecular formula C13H13ClN6O and a molecular weight of 304.74 g/mol. Its IUPAC name is N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
PubChem CID107623718
Molecular FormulaC13H13ClN6O
Molecular Weight304.74 g/mol
Exact Mass304.08
IUPAC NameN-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
SMILESCOc1cc(Nc2nc(NN)cn3ccnc23)ccc1Cl
InChIInChI=1S/C13H13ClN6O/c1-21-10-6-8(2-3-9(10)14)17-12-13-16-4-5-20(13)7-11(18-12)19-15/h2-7,19H,15H2,1H3,(H,17,18)
InChIKeyIOWYICWQKOHFIW-UHFFFAOYSA-N
XLogP2.42
TPSA89.50 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.74
LogP ≤ 52.42
H-Bond Donors ≤ 53
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 N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine (CID 107623718) is N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine is COc1cc(Nc2nc(NN)cn3ccnc23)ccc1Cl.
What is the InChIKey of N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is IOWYICWQKOHFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN6O/c1-21-10-6-8(2-3-9(10)14)17-12-13-16-4-5-20(13)7-11(18-12)19-15/h2-7,19H,15H2,1H3,(H,17,18).
What are the key properties of N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine?
N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 304.74 g/mol, XLogP of 2.42, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methoxyphenyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 107623718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).