Summary

IMPPAT Phytochemical identifier: IMPHY012517

Phytochemical name: N-Methylputrescine

Synonymous chemical names:
n-methylputrescine

External chemical identifiers:
CID:439791, ChEBI:17166, ZINC:ZINC000001529509, FDASRS:Y53JBS3498, SureChEMBL:SCHEMBL180051, MolPort-008-750-868

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Chemical structure information

SMILES:
CNCCCCN

InChI:
InChI=1S/C5H14N2/c1-7-5-3-2-4-6/h7H,2-6H2,1H3

InChIKey:
RMIVMBYMDISYFZ-UHFFFAOYSA-N

DeepSMILES:
CNCCCCN

Functional groups:
CN, CNC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic nitrogen compounds

ClassyFire Class: Organonitrogen compounds

ClassyFire Subclass: Amines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Ornithine alkaloids

NP Classifier Class: Polyamines

NP-Likeness score: 0.784

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Chemical structure download