N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine

C13H18N4O — CID 114471238

IUPACN-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESC=C(C)CCOc1nc(NCC)cn2ccnc12
InChIInChI=1S/C13H18N4O/c1-4-14-11-9-17-7-6-15-12(17)13(16-11)18-8-5-10(2)3/h6-7,9,14H,2,4-5,8H2,1,3H3
InChIKeyAYRQVVVMZSTPNG-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.51
Rot. Bonds6

About N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine

N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 114471238) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound NameN-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine
PubChem CID114471238
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC NameN-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESC=C(C)CCOc1nc(NCC)cn2ccnc12
InChIInChI=1S/C13H18N4O/c1-4-14-11-9-17-7-6-15-12(17)13(16-11)18-8-5-10(2)3/h6-7,9,14H,2,4-5,8H2,1,3H3
InChIKeyAYRQVVVMZSTPNG-UHFFFAOYSA-N
XLogP2.51
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-8-(4-methylpentoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80862180
N-ethyl-8-(2-methylpropoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80860201
N-ethyl-8-[(2-methylpropan-2-yl)oxy]imidazo[1,2-a]pyrazin-6-amine
CID 80861888
8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80842087
8-(2-ethoxyethoxy)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80859285
N-ethyl-8-(4-methylpentan-2-yloxy)imidazo[1,2-a]pyrazin-6-amine
CID 80859899
N-ethyl-8-(furan-2-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80858397
N-ethyl-8-(2-fluorophenoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80864193
8-(3,5-dimethylcyclohexyl)oxy-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80870488
N-methyl-8-(3,3,3-trifluoropropoxy)imidazo[1,2-a]pyrazin-6-amine
CID 82958083
8-(2,4-dimethylphenoxy)-N-ethylimidazo[1,2-a]pyrazin-6-amine
CID 80867122
N-ethyl-8-[(6-methyl-3-pyridinyl)oxy]imidazo[1,2-a]pyrazin-6-amine
CID 80873131

Frequently Asked Questions

What is the IUPAC name of N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine (CID 114471238) is N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine is C=C(C)CCOc1nc(NCC)cn2ccnc12.
What is the InChIKey of N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is AYRQVVVMZSTPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-4-14-11-9-17-7-6-15-12(17)13(16-11)18-8-5-10(2)3/h6-7,9,14H,2,4-5,8H2,1,3H3.
What are the key properties of N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine?
N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 246.31 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 114471238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).