5-(4-(4-Methoxybenzylamino)-5-aminopyridin-2-ylamino)pyrazine-2-carbonitrile

HCID 67017474
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(CNc2cc(Nc3cnc(C#N)cn3)ncc2N)cc1
InChIKey
ILTFCPCHSNAPKV-UHFFFAOYSA-N
Molecular formula
C18H17N7O
Average molar mass
347.4 g/mol

Names & identifiers

Preferred name
5-(4-(4-Methoxybenzylamino)-5-aminopyridin-2-ylamino)pyrazine-2-carbonitrile
IUPAC
5-[[5-amino-4-[(4-methoxyphenyl)methylamino]-2-pyridinyl]amino]pyrazine-2-carbonitrile

Names & synonyms

SCHEMBL1396988ILTFCPCHSNAPKV-UHFFFAOYSA-N5-(4-(4-Methoxybenzylamino)-5-aminopyridin-2-ylamino)pyrazine-2-carbonitrile

Database identifiers

PubChem CID
67017474

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
122 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
26

Related reactions

3 records
New reaction record

Linked notes

Loading…