caffeine

C8H10N4O2

Molecular FormulaC8H10N4O2

Molecular Weight194.19 g/mol

Exact Mass194.08037557

SMILESCN1C=NC2=C1C(=O)N(C(=O)N2C)C

InChIKeyRYYVLZVUVIJVGH-UHFFFAOYSA-N

XLogP-0.1

TPSA58.4 Å²

Complexity293

H-Bond Donors0

H-Bond Acceptors3

Rotatable Bonds0

Charge0

PubChem CID2519

Also Known As

caffeine58-08-2Guaranine1,3,7-TrimethylxanthineMethyltheobromineTheineTheinCafeinaCaffeinCafipelKoffeinMateinaAlert-pepCoffeineAnhydrous caffeineRefresh'nCaffedrineVivarinStimNo-Doz

Molecular Structure

View on PubChem