Basic information
- Standard SMILES
O=C(NC1CCC(Oc2ccc(F)cc2)CC1)NC12CC3CC(CC(C3)C1)C2- InChIKey
OWFWWRUQOVWLAN-UHFFFAOYSA-N- Molecular formula
- C23H31FN2O2
- Average molar mass
- 386.5 g/mol
- Monoisotopic mass
- 386.2369564
Names & identifiers
- Preferred name
- 1-(1-Adamantyl)-3-[4-(4-fluorophenoxy)cyclohexyl]urea
- IUPAC
- 1-(1-adamantyl)-3-[4-(4-fluorophenoxy)cyclohexyl]urea
Names & synonyms
CHEMBL243335CHEMBL3743221-(1-adamantyl)-3-[4-(4-fluorophenoxy)cyclohexyl]ureaSCHEMBL1062800SCHEMBL1062802SCHEMBL1065991OWFWWRUQOVWLAN-SAZHDORSSA-NBDBM50194500BDBM502174591-adamantan-1-yl-3-[4-(4-fluoro-phenoxy)-cyclohexyl]-ureacis-1-adamantan-1-yl-3-[4-(4-fluorophenoxy)cyclohexyl]-ureatrans-1-adamantan-1-yl-3-[4-(4-fluorophenoxy)cyclohexyl]-urea
Show more names
cis-1-[4-(4-Fluoro-phenoxy)-cyclohexyl]-3-tricyclo[3.3.1.13,7]decan-1-yl-urea
Database identifiers
- PubChem CID
- 11596176
- ChEMBL
CHEMBL243335、CHEMBL374322
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 526
Related reactions
1 records
Compound notes
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