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2-(4-aminophenyl)-N-undecan-2-ylcyclopropane-1-carboxamide (HCID 20529258)|Huagongshe
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Compound
2-(4-aminophenyl)-N-undecan-2-ylcyclopropane-1-carboxamide
HCID
20529258
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Basic information
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Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCCCC(C)NC(=O)C1CC1c1ccc(N)cc1
InChIKey
OKZRYVOMQQOINA-UHFFFAOYSA-N
Molecular formula
C21H34N2O
Average molar mass
330.5 g/mol
Monoisotopic mass
330.26711371
Names & identifiers
Preferred name
2-(4-aminophenyl)-N-undecan-2-ylcyclopropane-1-carboxamide
IUPAC
2-(4-aminophenyl)-N-undecan-2-ylcyclopropane-1-carboxamide
Names & synonyms
SCHEMBL11096204
Database identifiers
PubChem CID
20529258
Properties
Computed structural properties
XLogP
5.6
Topological polar surface area
55.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
11
Heavy atoms
24
Formal charge
0
Complexity
363
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Related reactions
1 records
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As solvent
HRID
1536636
As product
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Compound notes
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