Basic information
- CAS
120109-79-7- Standard SMILES
CCOC(=O)c1c(C2CC2)csc1NC(C)=O- InChIKey
WPFXUWHHLFCUCC-UHFFFAOYSA-N- Molecular formula
- C12H15NO3S
- Average molar mass
- 253.32 g/mol
- Monoisotopic mass
- 253.07726451
Names & identifiers
- Preferred name
- Ethyl 4-cyclopropyl-2-acetamidothiophene-3-carboxylate
- IUPAC
- ethyl 2-acetamido-4-cyclopropylthiophene-3-carboxylate
- English name
- ethyl 2-(acetylamino)-4-cyclopropyl-3-thiophenecarboxylate
- Molecular formula
- C12H15NO3S
- Molecular weight
- 253.3174
Names & synonyms
ethyl 2-acetamido-4-cyclopropylthiophene-3-carboxylateethyl 4-cyclopropyl-2-acetamidothiophene-3-carboxylateethyl 2-(acetylamino)-4-cyclopropyl-3-thiophenecarboxylateethyl 2-(acetylamino)-4-cyclopropylthiophene-3-carboxylateSMR000071560Oprea1_606614MLS000062551CHEMBL1609473HMS2387L10STK326507AKOS005431062ST4061995
Show more names
EU-0086063AN-319/15027003SR-01000532304SR-01000532304-14-cyclopropyl-2-(N-acetylamino)-3-carbethoxythiophene120109-79-7
Database identifiers
- CAS
120109-79-7- PubChem CID
- 704424
- ChEMBL
CHEMBL1609473
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 317
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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