5-(4-(piperidin-3-ylmethylamino)-5-(1H-pyrrol-1-yl)pyridin-2-ylamino)pyrazine-2-carbonitrile

HCID 59613498
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Basic information

Standard SMILES
N#Cc1cnc(Nc2cc(NCC3CCCNC3)c(-n3cccc3)cn2)cn1
InChIKey
ZVIFSSHTDFXJMV-UHFFFAOYSA-N
Molecular formula
C20H22N8
Average molar mass
374.4 g/mol

Names & identifiers

Preferred name
5-(4-(piperidin-3-ylmethylamino)-5-(1H-pyrrol-1-yl)pyridin-2-ylamino)pyrazine-2-carbonitrile
IUPAC
5-[[4-(piperidin-3-ylmethylamino)-5-pyrrol-1-yl-2-pyridinyl]amino]pyrazine-2-carbonitrile

Names & synonyms

SCHEMBL617285ZVIFSSHTDFXJMV-UHFFFAOYSA-N5-(4-(piperidin-3-ylmethylamino)-5-(1H-pyrrol-1-yl)pyridin-2-ylamino)pyrazine-2-carbonitrile

Database identifiers

PubChem CID
59613498

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
103 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

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