Molecule ID: 541551

IUPAC Name: 2-[4-(3-aminopropylamino)butyl]guanidine

Description: The molecule is a guanidine that consists of agmatine having a 3-aminopropyl group attached to the N-1 position. It derives from an agmatine. It is a conjugate base of a N(1)-aminopropylagmatine(3+).

SMILES: N=C(N)NCCCCNCCCN

SELFIES: [N][=C][Branch1][C][N][N][C][C][C][C][N][C][C][C][N]

InChI: InChI=1S/C8H21N5/c9-4-3-6-12-5-1-2-7-13-8(10)11/h12H,1-7,9H2,(H4,10,11,13)

Molecular Properties:
- Polar Surface Area: 102.0 Ų
- LogP: -1.6