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N-(1-phenylcyclohexyl)trimethylacetamide

HCID 12879909
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)(C)C(=O)NC1(c2ccccc2)CCCCC1
InChIKey
YYKICRLNQFLNDM-UHFFFAOYSA-N
Molecular formula
C17H25NO
Average molar mass
259.4 g/mol

Names & identifiers

Preferred name
N-(1-phenylcyclohexyl)trimethylacetamide
IUPAC
2,2-dimethyl-N-(1-phenylcyclohexyl)propanamide

Names & synonyms

SCHEMBL11311482YYKICRLNQFLNDM-UHFFFAOYSA-NN-(1-phenylcyclohexyl)trimethylacetamide

Database identifiers

PubChem CID
12879909

Properties

Computed structural properties

XLogP
4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
304

Related reactions

2 records
New reaction record
HRID 114575 reaction equation
HRID 114575As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 2287247 reaction equation
HRID 2287247As productuspto-grants-1981_05

Compound notes

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