HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-(Pyridine-2-carbonyl)cyclohexan-1-one

HCID 85528876
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
10198-84-2
Standard SMILES
O=C1CCCCC1C(=O)c1ccccn1
InChIKey
YXUGDDQOYBAXQQ-UHFFFAOYSA-N
Molecular formula
C12H13NO2
Average molar mass
203.24 g/mol
Monoisotopic mass
203.09462866

Names & identifiers

Preferred name
2-(Pyridine-2-carbonyl)cyclohexan-1-one
IUPAC
2-(pyridine-2-carbonyl)cyclohexan-1-one

Names & synonyms

2-(pyridine-2-carbonyl)cyclohexan-1-one10198-84-2DTXSID3012897972-(2-Pyridinylcarbonyl)cyclohexanone

Database identifiers

CAS
10198-84-2
PubChem CID
85528876
DTXSID
DTXSID301289797
Nikkaji
J584.528I

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
47 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Formal charge
0
Complexity
262

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes