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6-Ethyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one

HCID 22147481
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCC1Cc2cccnc2C1=O
InChIKey
UBBKLVNNHBPPLX-UHFFFAOYSA-N
Molecular formula
C10H11NO
Average molar mass
161.2 g/mol

Names & identifiers

Preferred name
6-Ethyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one
IUPAC
6-ethyl-5,6-dihydrocyclopenta[b]pyridin-7-one

Names & synonyms

6-Ethyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one535935-88-76-ethyl-5,6-dihydrocyclopenta[b]pyridin-7-oneSCHEMBL6098646UBBKLVNNHBPPLX-UHFFFAOYSA-N

Database identifiers

PubChem CID
22147481

Properties

Computed structural propertiesFilling in

XLogP
1.9
Topological polar surface area
30 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
190

Related reactions

5 records
New reaction record
HRID 1223321 reaction equation
HRID 1223321As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1612253 reaction equation
HRID 1612253As productuspto-grants-2006_01
HRID 1612254 reaction equation
HRID 1612254As reactantuspto-grants-2006_01
HRID 1824168 reaction equation
HRID 1824168As productuspto-grants-2006_05
HRID 1824169 reaction equation
HRID 1824169As reactantuspto-grants-2006_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes