7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C15H27N3 — CID 170207303

IUPAC7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCCCCCCCC(C)N1CCn2ccnc2C1
InChIInChI=1S/C15H27N3/c1-3-4-5-6-7-8-14(2)18-12-11-17-10-9-16-15(17)13-18/h9-10,14H,3-8,11-13H2,1-2H3
InChIKeyIVFGBDOUCDFOPM-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.45
Rot. Bonds7

About 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 170207303) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID170207303
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCCCCCCCC(C)N1CCn2ccnc2C1
InChIInChI=1S/C15H27N3/c1-3-4-5-6-7-8-14(2)18-12-11-17-10-9-16-15(17)13-18/h9-10,14H,3-8,11-13H2,1-2H3
InChIKeyIVFGBDOUCDFOPM-UHFFFAOYSA-N
XLogP3.45
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 170207303) is 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is CCCCCCCC(C)N1CCn2ccnc2C1.
What is the InChIKey of 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is IVFGBDOUCDFOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-3-4-5-6-7-8-14(2)18-12-11-17-10-9-16-15(17)13-18/h9-10,14H,3-8,11-13H2,1-2H3.
What are the key properties of 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 249.40 g/mol, XLogP of 3.45, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-nonan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 170207303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).