3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile

C11H17N5 — CID 63025616

IUPAC3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile
SMILESCCNC(C#N)CN1CCn2ccnc2C1
InChIInChI=1S/C11H17N5/c1-2-13-10(7-12)8-15-5-6-16-4-3-14-11(16)9-15/h3-4,10,13H,2,5-6,8-9H2,1H3
InChIKeyLVESFDAURAZUMD-UHFFFAOYSA-N
MW219.29 g/mol
LogP0.20
Rot. Bonds4

About 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile

3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile (PubChem CID 63025616) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile.

Molecular Properties

Compound Name3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile
PubChem CID63025616
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile
SMILESCCNC(C#N)CN1CCn2ccnc2C1
InChIInChI=1S/C11H17N5/c1-2-13-10(7-12)8-15-5-6-16-4-3-14-11(16)9-15/h3-4,10,13H,2,5-6,8-9H2,1H3
InChIKeyLVESFDAURAZUMD-UHFFFAOYSA-N
XLogP0.20
TPSA56.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile?
The IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile (CID 63025616) is 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile.
What is the SMILES notation for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile?
The canonical SMILES for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile is CCNC(C#N)CN1CCn2ccnc2C1.
What is the InChIKey of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile?
The InChIKey is LVESFDAURAZUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-2-13-10(7-12)8-15-5-6-16-4-3-14-11(16)9-15/h3-4,10,13H,2,5-6,8-9H2,1H3.
What are the key properties of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile?
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile has a molecular weight of 219.29 g/mol, XLogP of 0.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)propanenitrile is sourced from PubChem (CID 63025616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).