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1-(Pyridin-2-yl)imidazolidin-2-one

HCID 294241
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Basic information

CAS
53159-76-5
Standard SMILES
O=C1NCCN1c1ccccn1
InChIKey
QNTITXYHUMSSKB-UHFFFAOYSA-N
Molecular formula
C8H9N3O
Average molar mass
163.18 g/mol
Monoisotopic mass
163.07456191

Names & identifiers

Preferred name
1-(Pyridin-2-yl)imidazolidin-2-one
IUPAC
1-pyridin-2-ylimidazolidin-2-one

Names & synonyms

1-(pyridin-2-yl)imidazolidin-2-one53159-76-51-pyridin-2-ylimidazolidin-2-oneNSC 162270NSC162270pyridyl imidazolidinoneSCHEMBL2198674SCHEMBL8235167SCHEMBL30702779DTXSID30303819QNTITXYHUMSSKB-UHFFFAOYSA-NAKOS015917005
Show more names
NSC-162270DA-05158F2147-2444Z902619400

Database identifiers

CAS
53159-76-5
PubChem CID
294241
DTXSID
DTXSID30303819
Nikkaji
J2.588.591K

Properties

Computed structural propertiesFilling in

XLogP
0.1
Topological polar surface area
45.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
183

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Related reactions

5 records
New reaction record
HRID 458549 reaction equation
HRID 458549As productuspto-grants-2007_03
HRID 458550 reaction equation
HRID 458550As reactantuspto-grants-2007_03
HRID 1152948 reaction equation
HRID 1152948As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1442877 reaction equation
HRID 1442877As productuspto-grants-2010_02
HRID 1442878 reaction equation
HRID 1442878As reactantuspto-grants-2010_02

Compound notes

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