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1211519-07-1 molecular structure
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[5-(morpholin-4-yl)pyridin-3-yl]methanamine

ChemBase ID: 797695
Molecular Formular: C10H15N3O
Molecular Mass: 193.2456
Monoisotopic Mass: 193.12151212
SMILES and InChIs

SMILES:
C(N)c1cncc(c1)N1CCOCC1
Canonical SMILES:
NCc1cncc(c1)N1CCOCC1
InChI:
InChI=1S/C10H15N3O/c11-6-9-5-10(8-12-7-9)13-1-3-14-4-2-13/h5,7-8H,1-4,6,11H2
InChIKey:
MZTJFKPDTTVFRH-UHFFFAOYSA-N

Cite this record

CBID:797695 http://www.chembase.cn/molecule-797695.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[5-(morpholin-4-yl)pyridin-3-yl]methanamine
IUPAC Traditional name
[5-(morpholin-4-yl)pyridin-3-yl]methanamine
Synonyms
(5-Morpholinopyridin-3-yl)MethanaMine
CAS Number
1211519-07-1

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O9598 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O9598 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.1920855  LogD (pH = 7.4) -2.0642858 
Log P -0.22911477  Molar Refractivity 55.8776 cm3
Polarizability 21.26081 Å3 Polar Surface Area 51.38 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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