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1015846-25-9 molecular structure
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1-(piperidin-1-ylmethyl)cyclopropan-1-amine

ChemBase ID: 307955
Molecular Formular: C9H18N2
Molecular Mass: 154.25262
Monoisotopic Mass: 154.14699859
SMILES and InChIs

SMILES:
C1(CC1)(CN1CCCCC1)N
Canonical SMILES:
NC1(CC1)CN1CCCCC1
InChI:
InChI=1S/C9H18N2/c10-9(4-5-9)8-11-6-2-1-3-7-11/h1-8,10H2
InChIKey:
HFHCKUJNYGGXTK-UHFFFAOYSA-N

Cite this record

CBID:307955 http://www.chembase.cn/molecule-307955.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-(piperidin-1-ylmethyl)cyclopropan-1-amine
IUPAC Traditional name
1-(piperidin-1-ylmethyl)cyclopropan-1-amine
Synonyms
1-(piperidin-1-ylmethyl)cyclopropanamine
CAS Number
1015846-25-9
MDL Number
MFCD09971211

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.1997447  LogD (pH = 7.4) -1.9703966 
Log P 0.63288504  Molar Refractivity 47.1807 cm3
Polarizability 18.918522 Å3 Polar Surface Area 29.26 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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