8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine

C14H12N4O3 — CID 80843714

IUPAC8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(OCc2ccc3c(c2)OCO3)n1
InChIInChI=1S/C14H12N4O3/c15-12-6-18-4-3-16-13(18)14(17-12)19-7-9-1-2-10-11(5-9)21-8-20-10/h1-6H,7-8,15H2
InChIKeyNUJGISHMQXXABV-UHFFFAOYSA-N
MW284.28 g/mol
LogP1.62
Rot. Bonds3

About 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine

8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine (PubChem CID 80843714) has the molecular formula C14H12N4O3 and a molecular weight of 284.28 g/mol. Its IUPAC name is 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
PubChem CID80843714
Molecular FormulaC14H12N4O3
Molecular Weight284.28 g/mol
Exact Mass284.09
IUPAC Name8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine
SMILESNc1cn2ccnc2c(OCc2ccc3c(c2)OCO3)n1
InChIInChI=1S/C14H12N4O3/c15-12-6-18-4-3-16-13(18)14(17-12)19-7-9-1-2-10-11(5-9)21-8-20-10/h1-6H,7-8,15H2
InChIKeyNUJGISHMQXXABV-UHFFFAOYSA-N
XLogP1.62
TPSA83.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(1,3-benzodioxol-5-ylmethoxy)pyridin-2-amine
CID 113368057
8-[2-[di(propan-2-yl)amino]ethoxy]imidazo[1,2-a]pyrazin-6-amine
CID 115505952
4-(1,3-benzodioxol-5-ylmethoxy)-6-chloropyrimidin-5-amine
CID 63021904
[6-(1,3-benzodioxol-5-ylmethoxy)-3,5-dichloro-2-pyridinyl]hydrazine
CID 102762731
8-heptoxyimidazo[1,2-a]pyrazin-6-amine
CID 80861684
O-(1,3-benzodioxol-5-ylmethyl)hydroxylamine
CID 22419624
2-(1,3-benzodioxol-5-ylmethoxy)aniline
CID 11791381
[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
CID 80872480
[4-(1,3-benzodioxol-5-ylmethoxymethyl)-2-pyridinyl]methanamine
CID 63889462
2-(1,3-benzodioxol-5-ylmethoxy)-4,6-difluoroaniline
CID 115507284
2-[2-(1,3-benzodioxol-5-ylmethoxy)-3-pyridinyl]acetohydrazide
CID 142987779
6-(1,3-benzodioxol-5-ylmethoxy)-4-N-methylpyrimidine-2,4-diamine
CID 80860215

Frequently Asked Questions

What is the IUPAC name of 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine (CID 80843714) is 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine is Nc1cn2ccnc2c(OCc2ccc3c(c2)OCO3)n1.
What is the InChIKey of 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine?
The InChIKey is NUJGISHMQXXABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O3/c15-12-6-18-4-3-16-13(18)14(17-12)19-7-9-1-2-10-11(5-9)21-8-20-10/h1-6H,7-8,15H2.
What are the key properties of 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine?
8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine has a molecular weight of 284.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1,3-benzodioxol-5-ylmethoxy)imidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80843714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).