Home > Compound List > Compound details
938458-83-4 molecular structure
click picture or here to close

methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine

ChemBase ID: 306569
Molecular Formular: C12H24N2O
Molecular Mass: 212.33176
Monoisotopic Mass: 212.1888634
SMILES and InChIs

SMILES:
N1(C2(CNC)CCCCC2)CCOCC1
Canonical SMILES:
CNCC1(CCCCC1)N1CCOCC1
InChI:
InChI=1S/C12H24N2O/c1-13-11-12(5-3-2-4-6-12)14-7-9-15-10-8-14/h13H,2-11H2,1H3
InChIKey:
NYEQGTYSDSKVFR-UHFFFAOYSA-N

Cite this record

CBID:306569 http://www.chembase.cn/molecule-306569.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine
IUPAC Traditional name
methyl({[1-(morpholin-4-yl)cyclohexyl]methyl})amine
Synonyms
N-methyl-1-(1-morpholin-4-ylcyclohexyl)methanamine
CAS Number
938458-83-4
MDL Number
MFCD09055188

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 4002243 external link Add to cart
Data Source Data ID Price
ChemBridge
4002243 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) -2.5236802  LogD (pH = 7.4) -1.4099805 
Log P 1.3303049  Molar Refractivity 62.6908 cm3
Polarizability 25.1236 Å3 Polar Surface Area 24.5 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

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