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

C15H25N5 — CID 63026298

IUPAC6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile
SMILESCCNC(C)(C#N)CCCCN1CCn2ccnc2C1
InChIInChI=1S/C15H25N5/c1-3-18-15(2,13-16)6-4-5-8-19-10-11-20-9-7-17-14(20)12-19/h7,9,18H,3-6,8,10-12H2,1-2H3
InChIKeyVBMQFUMNUYJZFW-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.76
Rot. Bonds7

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

6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile (PubChem CID 63026298) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile.

Molecular Properties

Compound Name6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile
PubChem CID63026298
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile
SMILESCCNC(C)(C#N)CCCCN1CCn2ccnc2C1
InChIInChI=1S/C15H25N5/c1-3-18-15(2,13-16)6-4-5-8-19-10-11-20-9-7-17-14(20)12-19/h7,9,18H,3-6,8,10-12H2,1-2H3
InChIKeyVBMQFUMNUYJZFW-UHFFFAOYSA-N
XLogP1.76
TPSA56.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile
CID 64578836
2-(cyclopropylamino)-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylpentanenitrile
CID 63026125
N-tert-butyl-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-amine
CID 63026878
2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-ethylpentanenitrile
CID 106803570
5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methyl-2-(propylamino)pentanoic acid
CID 63026131
2-(cyclopropylamino)-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol
CID 64789888
7-(4-chlorobutyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 63026954
methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpropanoate
CID 63026304
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylpropan-1-ol
CID 64789691
1-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylpentan-2-ol
CID 64818722
2-(cyclopropylamino)-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylpentan-1-ol
CID 64790481
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-propan-2-ylpropan-1-amine
CID 63013047

Frequently Asked Questions

What is the IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile?
The IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile (CID 63026298) is 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile.
What is the SMILES notation for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile?
The canonical SMILES for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile is CCNC(C)(C#N)CCCCN1CCn2ccnc2C1.
What is the InChIKey of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile?
The InChIKey is VBMQFUMNUYJZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-3-18-15(2,13-16)6-4-5-8-19-10-11-20-9-7-17-14(20)12-19/h7,9,18H,3-6,8,10-12H2,1-2H3.
What are the key properties of 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile?
6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile has a molecular weight of 275.40 g/mol, XLogP of 1.76, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(ethylamino)-2-methylhexanenitrile is sourced from PubChem (CID 63026298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).