5-(4-[2-Propylguanidino]pyrimid-2-yl)valeramidine hydrochloride

HCID 20137149
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Basic information

Standard SMILES
CCCN=C(N)Nc1ccnc(CCCCC(=N)N)n1.Cl
InChIKey
XWXQCLKKBJOXEP-UHFFFAOYSA-N
Molecular formula
C13H24ClN7
Average molar mass
313.83 g/mol
Monoisotopic mass
313.1781715

Names & identifiers

Preferred name
5-(4-[2-Propylguanidino]pyrimid-2-yl)valeramidine hydrochloride
IUPAC
5-[4-[(N'-propylcarbamimidoyl)amino]pyrimidin-2-yl]pentanimidamide;hydrochloride

Names & synonyms

SCHEMBL10634775XWXQCLKKBJOXEP-UHFFFAOYSA-N5-(4-[2-propylguanidino]pyrimid-2-yl)valeramidine hydrochloride

Database identifiers

PubChem CID
20137149

Properties

Computed structural properties

Topological polar surface area
126 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
21

Related reactions

2 records
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Compound notes

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