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343271-89-6 molecular structure
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1-(pyridin-3-yl)pentan-1-amine

ChemBase ID: 307971
Molecular Formular: C10H16N2
Molecular Mass: 164.24744
Monoisotopic Mass: 164.13134852
SMILES and InChIs

SMILES:
c1(C(N)CCCC)cnccc1
Canonical SMILES:
CCCCC(c1cccnc1)N
InChI:
InChI=1S/C10H16N2/c1-2-3-6-10(11)9-5-4-7-12-8-9/h4-5,7-8,10H,2-3,6,11H2,1H3
InChIKey:
FPBYBHDBWKITIQ-UHFFFAOYSA-N

Cite this record

CBID:307971 http://www.chembase.cn/molecule-307971.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-(pyridin-3-yl)pentan-1-amine
IUPAC Traditional name
1-(pyridin-3-yl)pentan-1-amine
Synonyms
1-(3-pyridinyl)-1-pentanamine
CAS Number
343271-89-6
MDL Number
MFCD09864470

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.2742105  LogD (pH = 7.4) -0.28885642 
Log P 1.7095766  Molar Refractivity 50.5193 cm3
Polarizability 20.189428 Å3 Polar Surface Area 38.91 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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