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

C14H23N5 — CID 55142688

IUPAC5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile
SMILESCCNC(C)(C#N)CCCN1CCn2ccnc2C1
InChIInChI=1S/C14H23N5/c1-3-17-14(2,12-15)5-4-7-18-9-10-19-8-6-16-13(19)11-18/h6,8,17H,3-5,7,9-11H2,1-2H3
InChIKeyOYUBUHHLMUHGSJ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.37
Rot. Bonds6

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

5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile (PubChem CID 55142688) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile.

Molecular Properties

Compound Name5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile
PubChem CID55142688
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile
SMILESCCNC(C)(C#N)CCCN1CCn2ccnc2C1
InChIInChI=1S/C14H23N5/c1-3-17-14(2,12-15)5-4-7-18-9-10-19-8-6-16-13(19)11-18/h6,8,17H,3-5,7,9-11H2,1-2H3
InChIKeyOYUBUHHLMUHGSJ-UHFFFAOYSA-N
XLogP1.37
TPSA56.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile?
The IUPAC name of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile (CID 55142688) is 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile.
What is the SMILES notation for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile?
The canonical SMILES for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile is CCNC(C)(C#N)CCCN1CCn2ccnc2C1.
What is the InChIKey of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile?
The InChIKey is OYUBUHHLMUHGSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-3-17-14(2,12-15)5-4-7-18-9-10-19-8-6-16-13(19)11-18/h6,8,17H,3-5,7,9-11H2,1-2H3.
What are the key properties of 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile?
5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile has a molecular weight of 261.37 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpentanenitrile is sourced from PubChem (CID 55142688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).