ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine

C13H22N4O — CID 143756054

IUPACethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine
SMILESCC.CCOCCNc1nccn2c(C)cnc12
InChIInChI=1S/C11H16N4O.C2H6/c1-3-16-7-5-13-10-11-14-8-9(2)15(11)6-4-12-10;1-2/h4,6,8H,3,5,7H2,1-2H3,(H,12,13);1-2H3
InChIKeyMKGGBFJGTGNSSS-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.51
Rot. Bonds5

About ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine

ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 143756054) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Nameethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine
PubChem CID143756054
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Nameethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine
SMILESCC.CCOCCNc1nccn2c(C)cnc12
InChIInChI=1S/C11H16N4O.C2H6/c1-3-16-7-5-13-10-11-14-8-9(2)15(11)6-4-12-10;1-2/h4,6,8H,3,5,7H2,1-2H3,(H,12,13);1-2H3
InChIKeyMKGGBFJGTGNSSS-UHFFFAOYSA-N
XLogP2.51
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.51
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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Frequently Asked Questions

What is the IUPAC name of ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine (CID 143756054) is ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine is CC.CCOCCNc1nccn2c(C)cnc12.
What is the InChIKey of ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is MKGGBFJGTGNSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O.C2H6/c1-3-16-7-5-13-10-11-14-8-9(2)15(11)6-4-12-10;1-2/h4,6,8H,3,5,7H2,1-2H3,(H,12,13);1-2H3.
What are the key properties of ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine?
ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 250.35 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(2-ethoxyethyl)-3-methylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 143756054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).