2-Amino-5-[(5-pentylpyrimidin-2-yl)amino]pentanoic acid
Basic information
- CAS
55684-36-1- Standard SMILES
CCCCCc1cnc(NCCCC(N)C(=O)O)nc1- InChIKey
MJTYRANMLZKNRQ-UHFFFAOYSA-N- Molecular formula
- C14H24N4O2
- Average molar mass
- 280.37 g/mol
- Monoisotopic mass
- 280.18992602
Names & identifiers
- Preferred name
- 2-Amino-5-[(5-pentylpyrimidin-2-yl)amino]pentanoic acid
- IUPAC
- 2-amino-5-[(5-pentylpyrimidin-2-yl)amino]pentanoic acid
Names & synonyms
55684-36-1NSC2228152-amino-5-[(5-pentylpyrimidin-2-yl)amino]pentanoic acidDTXSID30310225NSC-222815N~5~-(5-Pentylpyrimidin-2-yl)ornithine
Database identifiers
- CAS
55684-36-1- PubChem CID
- 312673
- DTXSID
DTXSID30310225
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 268
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Compound notes
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