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N-[6-(adamantane-1-carbonylamino)hexyl]adamantane-1-carboxamide

HCID 337207
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
86583-07-5
Standard SMILES
O=C(NCCCCCCNC(=O)C12CC3CC(CC(C3)C1)C2)C12CC3CC(CC(C3)C1)C2
InChIKey
UVOICGWVASOGPR-UHFFFAOYSA-N
Molecular formula
C28H44N2O2
Average molar mass
440.7 g/mol
Monoisotopic mass
440.34027865

Names & identifiers

Preferred name
N-[6-(adamantane-1-carbonylamino)hexyl]adamantane-1-carboxamide
IUPAC
N-[6-(adamantane-1-carbonylamino)hexyl]adamantane-1-carboxamide

Names & synonyms

86583-07-5N-[6-(adamantane-1-carbonylamino)hexyl]adamantane-1-carboxamideST50748521NSC354306DTXSID20320055STK448553AKOS000511670NSC-354306AH-357/03533011N,N'-(Hexane-1,6-diyl)di(adamantane-1-carboxamide)adamantanyl-N-[6-(adamantanylcarbonylamino)hexyl]carboxamideN-{6-[(1-adamantylcarbonyl)amino]hexyl}-1-adamantanecarboxamide
Show more names
N,N'-hexane-1,6-diylbistricyclo[3.3.1.1~3,7~]decane-1-carboxamide

Database identifiers

CAS
86583-07-5
PubChem CID
337207
DTXSID
DTXSID20320055
Nikkaji
J1.688.633E

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
32
Formal charge
0
Complexity
599

Related reactions

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Compound notes

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