Molecule

2-Amino-4-pyrimidinecarboxylic acid

AlkaPlorer ID: AK245814

Synonym: None

IUPAC Name: 2-aminopyrimidine-4-carboxylic acid

SMILES: NC1=NC=CC(C(=O)O)=N1

InChI: InChI=1S/C5H5N3O2/c6-5-7-2-1-3(8-5)4(9)10/h1-2H,(H,9,10)(H2,6,7,8)

InChIKey: GKFPFLBDQJVJIH-UHFFFAOYSA-N

PubChem CID: 247194

CAS: 2164-65-0

LOTUS: LTS0223674

SuperNatural Ⅲ: SN0107935

COCONUT: CNP0302261

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Lathyrus tingitanus	Lathyrus	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 139.11399999999998

TPSA？: 89.1

MolLogP？: -0.2430000000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 1

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi

AKRT ID	Reaction	Reaction Link ID
AKRT013589	C[C@H](N)C(=O)O.Nc1nccc(C(=O)O)n1>>Nc1nccc(C[C@H](N)C(=O)O)n1	MNXR191902
AKRT019473	N[C@@H](CO)C(=O)O.Nc1nccc(C(=O)O)n1>>Nc1nccc(C[C@H](N)C(=O)O)n1	RXN-7
AKRT021611	Nc1nccc(C(=O)O)n1>>O=C=O	RXN-7
AKRT023393	O=C(O)c1ccnc(O)n1>>Nc1nccc(C(=O)O)n1	RXN-6