(S)-tert-Butyl 1-amino-3-cyclopropyl-1-thioxopropan-2-ylcarbamate
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](CC1CC1)C(N)=S- InChIKey
NOFWXADUJSXMQC-QMMMGPOBSA-N- Molecular formula
- C11H20N2O2S
- Average molar mass
- 244.36 g/mol
- Monoisotopic mass
- 244.12454906
Names & identifiers
- Preferred name
- (S)-tert-Butyl 1-amino-3-cyclopropyl-1-thioxopropan-2-ylcarbamate
- IUPAC
- tert-butyl N-[(2S)-1-amino-3-cyclopropyl-1-sulfanylidenepropan-2-yl]carbamate
Names & synonyms
SCHEMBL14152032NOFWXADUJSXMQC-QMMMGPOBSA-N(S)-tert-Butyl 1-amino-3-cyclopropyl-1-thioxopropan-2-ylcarbamate
Database identifiers
- PubChem CID
- 86674751
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 96.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
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Related reactions
2 records
Compound notes
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