4-(cyanomethyl)-N-(2-hydroxycyclohexyl)-3-methoxybenzamide

HCID 21990973
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Basic information

Standard SMILES
COc1cc(C(=O)NC2CCCCC2O)ccc1CC#N
InChIKey
UWUPPEFWPBCOLZ-UHFFFAOYSA-N
Molecular formula
C16H20N2O3
Average molar mass
288.34 g/mol

Names & identifiers

Preferred name
4-(cyanomethyl)-N-(2-hydroxycyclohexyl)-3-methoxybenzamide
IUPAC
4-(cyanomethyl)-N-(2-hydroxycyclohexyl)-3-methoxybenzamide

Database identifiers

PubChem CID
21990973

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
82.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
21

Related reactions

2 records
New reaction record

Compound notes

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