3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine

C16H20N6O — CID 143756890

IUPAC3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCCn1cc(-c2cnc3c(NC4CCOCC4)nccn23)cn1
InChIInChI=1S/C16H20N6O/c1-2-21-11-12(9-19-21)14-10-18-16-15(17-5-6-22(14)16)20-13-3-7-23-8-4-13/h5-6,9-11,13H,2-4,7-8H2,1H3,(H,17,20)
InChIKeyUFTJLIOUEZSBQX-UHFFFAOYSA-N
MW312.38 g/mol
LogP2.20
Rot. Bonds4

About 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine

3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 143756890) has the molecular formula C16H20N6O and a molecular weight of 312.38 g/mol. Its IUPAC name is 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID143756890
Molecular FormulaC16H20N6O
Molecular Weight312.38 g/mol
Exact Mass312.17
IUPAC Name3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCCn1cc(-c2cnc3c(NC4CCOCC4)nccn23)cn1
InChIInChI=1S/C16H20N6O/c1-2-21-11-12(9-19-21)14-10-18-16-15(17-5-6-22(14)16)20-13-3-7-23-8-4-13/h5-6,9-11,13H,2-4,7-8H2,1H3,(H,17,20)
InChIKeyUFTJLIOUEZSBQX-UHFFFAOYSA-N
XLogP2.20
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine (CID 143756890) is 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine is CCn1cc(-c2cnc3c(NC4CCOCC4)nccn23)cn1.
What is the InChIKey of 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is UFTJLIOUEZSBQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O/c1-2-21-11-12(9-19-21)14-10-18-16-15(17-5-6-22(14)16)20-13-3-7-23-8-4-13/h5-6,9-11,13H,2-4,7-8H2,1H3,(H,17,20).
What are the key properties of 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine?
3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 312.38 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpyrazol-4-yl)-N-(oxan-4-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 143756890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).