(2R,3R)-2-(4-Cyanonaphthalen-1-ylamino)-3-hydroxybutanoic acid

HCID 67006249
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Basic information

Standard SMILES
C[C@@H](O)[C@@H](Nc1ccc(C#N)c2ccccc12)C(=O)O
InChIKey
MKMPVUNWOCPCCC-YMTOWFKASA-N
Molecular formula
C15H14N2O3
Average molar mass
270.28 g/mol

Names & identifiers

Preferred name
(2R,3R)-2-(4-Cyanonaphthalen-1-ylamino)-3-hydroxybutanoic acid
IUPAC
(2R,3R)-2-[(4-cyanonaphthalen-1-yl)amino]-3-hydroxybutanoic acid

Names & synonyms

SCHEMBL1363880MKMPVUNWOCPCCC-YMTOWFKASA-N(2R,3R)-2-(4-Cyanonaphthalen-1-ylamino)-3-hydroxybutanoic acid

Database identifiers

PubChem CID
67006249

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
93.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
20

Related reactions

12 records
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Linked notes

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