Home > Compound List > Compound details
124491-96-9 molecular structure
click picture or here to close

2-amino-N,N-dimethylpropanamide

ChemBase ID: 257984
Molecular Formular: C5H12N2O
Molecular Mass: 116.16158
Monoisotopic Mass: 116.09496301
SMILES and InChIs

SMILES:
C(=O)(N(C)C)C(N)C
Canonical SMILES:
O=C(N(C)C)C(N)C
InChI:
InChI=1S/C5H12N2O/c1-4(6)5(8)7(2)3/h4H,6H2,1-3H3
InChIKey:
WSFGOLVWRKEQOW-UHFFFAOYSA-N

Cite this record

CBID:257984 http://www.chembase.cn/molecule-257984.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-amino-N,N-dimethylpropanamide
IUPAC Traditional name
2-amino-N,N-dimethylpropanamide
Synonyms
2-amino-N,N-dimethylpropanamide
N~1~,N~1~-dimethylalaninamide
CAS Number
124491-96-9
MDL Number
MFCD09936145
PubChem SID
164313894
PubChem CID
12653781

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 12653781 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.588814  LogD (pH = 7.4) -1.9594479 
Log P -0.9383018  Molar Refractivity 32.1129 cm3
Polarizability 12.678941 Å3 Polar Surface Area 46.33 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Product Information Bioassay(PubChem)
Hydrophobicity(logP)
-0.866 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