Basic information
- CAS
57568-81-7- Standard SMILES
S=C(NC12CC3CC(CC(C3)C1)C2)N1CCOCC1- InChIKey
XXSPADLRFLRABD-UHFFFAOYSA-N- Molecular formula
- C15H24N2OS
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.16093439
Names & identifiers
- Preferred name
- N-(1-adamantyl)morpholine-4-carbothioamide
- IUPAC
- N-(1-adamantyl)morpholine-4-carbothioamide
Names & synonyms
57568-81-7N-(1-Adamantyl)-4-morpholinethiocarboxamideN-Tricyclo[3.3.1.13,7]dec-1-yl-4-morpholinecarbothioamideN-(1-adamantyl)morpholine-4-carbothioamideCBDivE_016045MLS000712661CHEMBL1881860SCHEMBL11705673XXSPADLRFLRABD-UHFFFAOYSA-NDTXSID201196428HMS1676D09HMS2671J13
Show more names
AKOS000546030SMR000282428AB00049296-01AB00049296-02N-(ADAMANTAN-1-YL)MORPHOLINE-4-CARBOTHIOAMIDEZ55175347
Database identifiers
- CAS
57568-81-7- PubChem CID
- 2828003
- DTXSID
DTXSID201196428- ChEMBL
CHEMBL1881860
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 337
Related reactions
1 records
Compound notes
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