2-(2-Amino-3-phenylpropanamido)-3-methylbutanoic acid
Basic information
- CAS
3918-89-6- Standard SMILES
CC(C)C(NC(=O)C(N)Cc1ccccc1)C(=O)O- InChIKey
IEHDJWSAXBGJIP-UHFFFAOYSA-N- Molecular formula
- C14H20N2O3
- Average molar mass
- 264.32 g/mol
- Monoisotopic mass
- 264.1473925
Overview
Phenylalanyl-Valine is a dipeptide.
Names & identifiers
- Preferred name
- 2-(2-Amino-3-phenylpropanamido)-3-methylbutanoic acid
- IUPAC
- 2-[(2-amino-3-phenylpropanoyl)amino]-3-methylbutanoic acid
Names & synonyms
2-(2-amino-3-phenylpropanamido)-3-methylbutanoic acid(R)-2-((R)-2-Amino-3-phenylpropanamido)-3-methylbutanoic acidSCHEMBL4434431CHEBI:173876IEHDJWSAXBGJIP-UHFFFAOYSA-N2-[(2-amino-3-phenylpropanoyl)amino]-3-methylbutanoic acidDTXSID601344958FVAKOS0100551513918-89-6ST51015102N-(2-Amino-1-hydroxy-3-phenylpropylidene)valine
Show more names
2-(2-amino-3-phenylpropanoylamino)-3-methylbutanoic acid
Database identifiers
- CAS
3918-89-6- PubChem CID
- 4096934
- DTXSID
DTXSID601344958- ChEBI
CHEBI:173876
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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