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2-ethyl-N-(2-pyridinylmethyl)hexanamide

HCID 3597150
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Basic information

CAS
111711-25-2
Standard SMILES
CCCCC(CC)C(=O)NCc1ccccn1
InChIKey
GRVLXKVQWBUDNK-UHFFFAOYSA-N
Molecular formula
C14H22N2O
Average molar mass
234.34 g/mol
Monoisotopic mass
234.17321333

Names & identifiers

Preferred name
2-ethyl-N-(2-pyridinylmethyl)hexanamide
IUPAC
2-ethyl-N-(pyridin-2-ylmethyl)hexanamide
English name
2-ethyl-N-(2-pyridinylmethyl)hexanamide
Molecular formula
C14H22N2O
Molecular weight
234.33728

Names & synonyms

2-ethyl-N-(2-pyridinylmethyl)hexanamide111711-25-2Hexanamide, 2-ethyl-N-(2-pyridinylmethyl)-2-ethyl-N-(pyridin-2-ylmethyl)hexanamideSCHEMBL10352587DTXSID701266236AKOS0038804332-Ethyl-N-[(pyridin-2-yl)methyl]hexanamideAG-690/15437186

Database identifiers

CAS
111711-25-2
PubChem CID
3597150
DTXSID
DTXSID701266236

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
17
Formal charge
0
Complexity
218

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Compound notes

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