3-(1,6-dihydro-6-oxo-9H-purin-9-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]propanamide

HCID 136100714
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Basic information

Standard SMILES
CN1CCCC1CCNC(=O)CCn1cnc2c(=O)[nH]cnc21
InChIKey
OOKMYKMUIFZMRM-UHFFFAOYSA-N
Molecular formula
C15H22N6O2
Average molar mass
318.37 g/mol
Monoisotopic mass
318.18042397

Names & identifiers

Preferred name
3-(1,6-dihydro-6-oxo-9H-purin-9-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]propanamide
IUPAC
N-[2-(1-methylpyrrolidin-2-yl)ethyl]-3-(6-oxo-1H-purin-9-yl)propanamide

Names & synonyms

SCHEMBL7399472OOKMYKMUIFZMRM-UHFFFAOYSA-N3-(1,6-dihydro-6-oxo-9H-purin-9-yl)-N-[2-(1-methylpyrrolidin-2-yl)ethyl]propanamide

Database identifiers

PubChem CID
136100714

Properties

Computed structural properties

XLogP
-0.4
Topological polar surface area
91.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
23

Related reactions

2 records
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Compound notes

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