N-(5-aminopentyl)-2-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-amine

HCID 86636620
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Basic information

Standard SMILES
NCCCCCNc1nc(Cl)nc2[nH]ccc12
InChIKey
PCRUPLRBTAUFDW-UHFFFAOYSA-N
Molecular formula
C11H16ClN5
Average molar mass
253.73 g/mol

Names & identifiers

Preferred name
N-(5-aminopentyl)-2-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-amine
IUPAC
N'-(2-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pentane-1,5-diamine

Names & synonyms

SCHEMBL1019719PCRUPLRBTAUFDW-UHFFFAOYSA-NDB-101641N-(5-aminopentyl)-2-chloro-7H-pyrrolo[2,3-d]pyrimidin-4-amine1192711-78-6

Database identifiers

PubChem CID
86636620

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
79.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
17

Related reactions

6 records
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Compound notes

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