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-Amino-5-[4-(3-fluorooxetan-3-yl)phenyl]thiophene-3-carboxamide

HCID 59526237
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
NC(=O)c1cc(-c2ccc(C3(F)COC3)cc2)sc1N
InChIKey
RENRXEVPZMWRIU-UHFFFAOYSA-N
Molecular formula
C14H13FN2O2S
Average molar mass
292.33 g/mol
Monoisotopic mass
292.068177

Names & identifiers

Preferred name
2-Amino-5-[4-(3-fluorooxetan-3-yl)phenyl]thiophene-3-carboxamide
IUPAC
2-amino-5-[4-(3-fluorooxetan-3-yl)phenyl]thiophene-3-carboxamide

Names & synonyms

SCHEMBL3510510RENRXEVPZMWRIU-UHFFFAOYSA-N2-amino-5-[4-(3-fluorooxetan-3-yl)phenyl]thiophene-3-carboxamide

Database identifiers

PubChem CID
59526237

Properties

Computed structural properties

XLogP
2
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
383

Related reactions

4 records
New reaction record
HRID 174379 reaction equation
HRID 174379As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 385724 reaction equation
HRID 385724As productuspto-grants-2013_02
HRID 385852 reaction equation
HRID 385852As reactantuspto-grants-2013_02
HRID 2326115 reaction equation
HRID 2326115As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes