1-(5-Boronopyrimidin-2-yl)piperidine-4-carboxylic acid

HCID 89923701
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Basic information

Standard SMILES
O=C(O)C1CCN(c2ncc(B(O)O)cn2)CC1
InChIKey
ZXMDWUUKNJFDIG-UHFFFAOYSA-N
Molecular formula
C10H14BN3O4
Average molar mass
251.05 g/mol
Monoisotopic mass
251.1077361

Names & identifiers

Preferred name
1-(5-Boronopyrimidin-2-yl)piperidine-4-carboxylic acid
IUPAC
1-(5-boronopyrimidin-2-yl)piperidine-4-carboxylic acid

Names & synonyms

1-(5-Boronopyrimidin-2-yl)piperidine-4-carboxylic acid1515925-20-8SCHEMBL15415151ZXMDWUUKNJFDIG-UHFFFAOYSA-NDB-201083A1-135241-(5-Borono-2-pyrimidinyl)-4-piperidinecarboxylic acid1-[5-(Dihydroxyboranyl)pyrimidin-2-yl]piperidine-4-carboxylic acid

Database identifiers

PubChem CID
89923701

Properties

Computed structural properties

Topological polar surface area
107 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
18

Related reactions

1 records
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Compound notes

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