tert-Butyl 3-(hydroxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate

Substructure search Find similar structures

Basic information

CAS: 1260876-41-2
Standard SMILES: CC(C)(C)OC(=O)N1CCCn2ncc(CO)c21
InChIKey: MOIUIWRCMPEHAE-UHFFFAOYSA-N
Molecular formula: C12H19N3O3
Average molar mass: 253.3 g/mol
Monoisotopic mass: 253.14264148

Names & identifiers

Preferred name: tert-Butyl 3-(hydroxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate
IUPAC: tert-butyl 3-(hydroxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidine-4-carboxylate

Names & synonyms

1260876-41-2tert-Butyl 3-(hydroxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylateDTXSID50857647tert-Butyl3-(hydroxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrimidine-4(5H)-carboxylate

Database identifiers

CAS: 1260876-41-2
PubChem CID: 71748552
DTXSID: DTXSID50857647

Properties

Computed structural properties

XLogP: 0.5
Topological polar surface area: 67.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 316

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…