CCOC(=O)C1=CN(N=C1N)C2CCC2
CAS: 950860-11-4
Nombre: ethyl 3-amino-1-cyclobutylpyrazole-4-carboxylate
SMILES: CCOC(=O)C1=CN(N=C1N)C2CCC2

Molecular Processing

Molecular formula
C10H15N3O2
Molecular weight
209.25
Exact mass
209.1164
XLogP
1.37
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
55.48

Supplementary Information

InChIKey: PUQDHBGTQIUWEP-UHFFFAOYSA-N
Sinónimos
SCHEMBL1406797PUQDHBGTQIUWEP-UHFFFAOYSA-NDB-142136Ethyl 3-amino-1-cyclobutyl-1H-pyrazole-4-carboxylate3-amino-1-cyclobutyl-1H-pyrazole-4-carboxylic acid ethyl ester950860-11-4
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