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N-[10-(adamantane-1-carbonylamino)decyl]adamantane-1-carboxamide

HCID 337305
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Basic information

CAS
86583-12-2
Standard SMILES
O=C(NCCCCCCCCCCNC(=O)C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2
InChIKey
ADINJXAKUCNIRG-UHFFFAOYSA-N
Molecular formula
C32H52N2O2
Average molar mass
496.8 g/mol
Monoisotopic mass
496.40287891

Names & identifiers

Preferred name
N-[10-(adamantane-1-carbonylamino)decyl]adamantane-1-carboxamide
IUPAC
N-[10-(adamantane-1-carbonylamino)decyl]adamantane-1-carboxamide

Names & synonyms

86583-12-2N,N'-1,10-decanediyldi(1-adamantanecarboxamide)ST50215968NSC354688DTXSID10320089N-[10-(adamantane-1-carbonylamino)decyl]adamantane-1-carboxamideSTK449023AKOS000674569NSC-354688N,N'-(Decane-1,10-diyl)di(adamantane-1-carboxamide)adamantanyl-N-[10-(adamantanylcarbonylamino)decyl]carboxamideN,N'-decane-1,10-diylbistricyclo[3.3.1.1~3,7~]decane-1-carboxamide

Database identifiers

CAS
86583-12-2
PubChem CID
337305
DTXSID
DTXSID10320089
Nikkaji
J3.192.868K

Properties

Computed structural properties

XLogP
7.6
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
13
Heavy atoms
36
Formal charge
0
Complexity
655

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