Home > Compound List > Compound details
880361-77-3 molecular structure
click picture or here to close

{6-methylimidazo[1,2-a]pyridin-2-yl}methanamine

ChemBase ID: 279014
Molecular Formular: C9H11N3
Molecular Mass: 161.20374
Monoisotopic Mass: 161.09529737
SMILES and InChIs

SMILES:
n12c(nc(c1)CN)ccc(c2)C
Canonical SMILES:
NCc1cn2c(n1)ccc(c2)C
InChI:
InChI=1S/C9H11N3/c1-7-2-3-9-11-8(4-10)6-12(9)5-7/h2-3,5-6H,4,10H2,1H3
InChIKey:
AXPYEDCFAFVWAD-UHFFFAOYSA-N

Cite this record

CBID:279014 http://www.chembase.cn/molecule-279014.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
{6-methylimidazo[1,2-a]pyridin-2-yl}methanamine
IUPAC Traditional name
{6-methylimidazo[1,2-a]pyridin-2-yl}methanamine
Synonyms
{6-methylimidazo[1,2-a]pyridin-2-yl}methanamine
1-(6-methylimidazo[1,2-a]pyridin-2-yl)methanamine
CAS Number
880361-77-3
MDL Number
MFCD08669762
PubChem SID
164334924
PubChem CID
26248964

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 26248964 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.302287  LogD (pH = 7.4) -0.72980905 
Log P 0.48021114  Molar Refractivity 48.9288 cm3
Polarizability 18.4163 Å3 Polar Surface Area 43.32 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Product Information Bioassay(PubChem)
Hydrophobicity(logP)
0.857 expand Show data source
Purity
95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle