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N-(2-(Pyridin-2-yl)ethyl)acetamide

HCID 238301
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
6304-22-9
Standard SMILES
CC(=O)NCCc1ccccn1
InChIKey
ITPOTYPCMARYOB-UHFFFAOYSA-N
Molecular formula
C9H12N2O
Average molar mass
164.2 g/mol
Monoisotopic mass
164.09496301

Names & identifiers

Preferred name
N-(2-(Pyridin-2-yl)ethyl)acetamide
IUPAC
N-(2-pyridin-2-ylethyl)acetamide

Names & synonyms

N-(2-(Pyridin-2-yl)ethyl)acetamide6304-22-9N-(2-pyridin-2-ylethyl)acetamiden-[2-(pyridin-2-yl)ethyl]acetamideNSC42621SCHEMBL48652SCHEMBL4291292-(2-acetylaminoethyl)pyridineCHEMBL3244511DTXSID70285680ITPOTYPCMARYOB-UHFFFAOYSA-NN-[2-(2-Pyridinyl)ethyl]acetamide
Show more names
NSC-42621AKOS008932694SB54680Acetamide, N-[2-(2-pyridinyl)ethyl]-DS-011556CS-0277985Z32445986

Database identifiers

CAS
6304-22-9
PubChem CID
238301
DTXSID
DTXSID70285680
ChEMBL
CHEMBL3244511

Properties

Computed structural properties

XLogP
0.1
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
147

Related reactions

6 records
New reaction record
HRID 188787 reaction equation
HRID 188787As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 247923 reaction equation
HRID 247923As productuspto-grants-1993_05
HRID 290413 reaction equation
HRID 290413As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1491829 reaction equation
HRID 1491829As reactantuspto-grants-1994_12
HRID 1728799 reaction equation
HRID 1728799As productuspto-grants-1994_07
HRID 2379812 reaction equation
HRID 2379812As reactantuspto-grants-1994_11

Compound notes

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