2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile

C13H21N5 — CID 106803570

IUPAC2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile
SMILESCCC(N)(C#N)CCCN1CCn2ccnc2C1
InChIInChI=1S/C13H21N5/c1-2-13(15,11-14)4-3-6-17-8-9-18-7-5-16-12(18)10-17/h5,7H,2-4,6,8-10,15H2,1H3
InChIKeyHNPRGWGVQMVMSB-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.11
Rot. Bonds5

About 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile

2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile (PubChem CID 106803570) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile.

Molecular Properties

Compound Name2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile
PubChem CID106803570
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile
SMILESCCC(N)(C#N)CCCN1CCn2ccnc2C1
InChIInChI=1S/C13H21N5/c1-2-13(15,11-14)4-3-6-17-8-9-18-7-5-16-12(18)10-17/h5,7H,2-4,6,8-10,15H2,1H3
InChIKeyHNPRGWGVQMVMSB-UHFFFAOYSA-N
XLogP1.11
TPSA70.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile?
The IUPAC name of 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile (CID 106803570) is 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile.
What is the SMILES notation for 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile?
The canonical SMILES for 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile is CCC(N)(C#N)CCCN1CCn2ccnc2C1.
What is the InChIKey of 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile?
The InChIKey is HNPRGWGVQMVMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-2-13(15,11-14)4-3-6-17-8-9-18-7-5-16-12(18)10-17/h5,7H,2-4,6,8-10,15H2,1H3.
What are the key properties of 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile?
2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile has a molecular weight of 247.35 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile is sourced from PubChem (CID 106803570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).