N-((1S)-1-cyclohexylethyl)-3-fluoro-4-(2-propynyloxy)benzamide

HCID 57701210
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Basic information

Standard SMILES
C#CCOc1ccc(C(=O)N[C@@H](C)C2CCCCC2)cc1F
InChIKey
RMVWSDUMBYDHST-ZDUSSCGKSA-N
Molecular formula
C18H22FNO2
Average molar mass
303.4 g/mol
Monoisotopic mass
303.16345711

Names & identifiers

Preferred name
N-((1S)-1-cyclohexylethyl)-3-fluoro-4-(2-propynyloxy)benzamide
IUPAC
N-[(1S)-1-cyclohexylethyl]-3-fluoro-4-prop-2-ynoxybenzamide

Names & synonyms

SCHEMBL4244962RMVWSDUMBYDHST-ZDUSSCGKSA-NN-((1S)-1-cyclohexylethyl)-3-fluoro-4-(2-propynyloxy)benzamide

Database identifiers

PubChem CID
57701210

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
22

Related reactions

1 records
New reaction record

Linked notes

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