N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine

C10H11F3N4O — CID 166604696

IUPACN-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCNc1nccn2cc(C(F)(F)F)nc12
InChIInChI=1S/C10H11F3N4O/c1-18-5-3-15-8-9-16-7(10(11,12)13)6-17(9)4-2-14-8/h2,4,6H,3,5H2,1H3,(H,14,15)
InChIKeyIBDOATPKCSQBPP-UHFFFAOYSA-N
MW260.22 g/mol
LogP1.81
Rot. Bonds4

About N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine

N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 166604696) has the molecular formula C10H11F3N4O and a molecular weight of 260.22 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID166604696
Molecular FormulaC10H11F3N4O
Molecular Weight260.22 g/mol
Exact Mass260.09
IUPAC NameN-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCNc1nccn2cc(C(F)(F)F)nc12
InChIInChI=1S/C10H11F3N4O/c1-18-5-3-15-8-9-16-7(10(11,12)13)6-17(9)4-2-14-8/h2,4,6H,3,5H2,1H3,(H,14,15)
InChIKeyIBDOATPKCSQBPP-UHFFFAOYSA-N
XLogP1.81
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.22
LogP ≤ 51.81
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 N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine (CID 166604696) is N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine is COCCNc1nccn2cc(C(F)(F)F)nc12.
What is the InChIKey of N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is IBDOATPKCSQBPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N4O/c1-18-5-3-15-8-9-16-7(10(11,12)13)6-17(9)4-2-14-8/h2,4,6H,3,5H2,1H3,(H,14,15).
What are the key properties of N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine?
N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 260.22 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 166604696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).