N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine

C17H20N10O — CID 143756584

IUPACN-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESCNn1cc(-c2cnc3c(Nc4ccnc(OCCNN)c4)nccn23)cn1
InChIInChI=1S/C17H20N10O/c1-19-27-11-12(9-24-27)14-10-22-17-16(21-4-6-26(14)17)25-13-2-3-20-15(8-13)28-7-5-23-18/h2-4,6,8-11,19,23H,5,7,18H2,1H3,(H,20,21,25)
InChIKeyYSLYCYDIYVCVJQ-UHFFFAOYSA-N
MW380.42 g/mol
LogP0.75
Rot. Bonds8

About N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine

N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 143756584) has the molecular formula C17H20N10O and a molecular weight of 380.42 g/mol. Its IUPAC name is N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID143756584
Molecular FormulaC17H20N10O
Molecular Weight380.42 g/mol
Exact Mass380.18
IUPAC NameN-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine
SMILESCNn1cc(-c2cnc3c(Nc4ccnc(OCCNN)c4)nccn23)cn1
InChIInChI=1S/C17H20N10O/c1-19-27-11-12(9-24-27)14-10-22-17-16(21-4-6-26(14)17)25-13-2-3-20-15(8-13)28-7-5-23-18/h2-4,6,8-11,19,23H,5,7,18H2,1H3,(H,20,21,25)
InChIKeyYSLYCYDIYVCVJQ-UHFFFAOYSA-N
XLogP0.75
TPSA132.24 Ų
H-Bond Donors4
H-Bond Acceptors11
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.42
LogP ≤ 50.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine (CID 143756584) is N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine is CNn1cc(-c2cnc3c(Nc4ccnc(OCCNN)c4)nccn23)cn1.
What is the InChIKey of N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is YSLYCYDIYVCVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N10O/c1-19-27-11-12(9-24-27)14-10-22-17-16(21-4-6-26(14)17)25-13-2-3-20-15(8-13)28-7-5-23-18/h2-4,6,8-11,19,23H,5,7,18H2,1H3,(H,20,21,25).
What are the key properties of N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine?
N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 380.42 g/mol, XLogP of 0.75, 8 rotatable bonds, 4 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydrazinylethoxy)-4-pyridinyl]-3-[1-(methylamino)pyrazol-4-yl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 143756584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).