4-(3-aminopropyl)-6-[5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-ylamine

HCID 25165367
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Basic information

Standard SMILES
Cn1cc(-c2cnc3[nH]cc(-c4cc(CCCN)nc(N)n4)c3c2)cn1
InChIKey
DXWQATYOPZRVTG-UHFFFAOYSA-N
Molecular formula
C18H20N8
Average molar mass
348.4 g/mol

Names & identifiers

Preferred name
4-(3-aminopropyl)-6-[5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-ylamine
IUPAC
4-(3-aminopropyl)-6-[5-(1-methylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-amine

Names & synonyms

SCHEMBL1603274DXWQATYOPZRVTG-UHFFFAOYSA-N4-(3-aminopropyl)-6-[5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyrimidin-2-ylamine

Database identifiers

PubChem CID
25165367

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
124 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

Related reactions

2 records
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Compound notes

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