CCOC(=O)C1=C(N(N=C1)C2CC2)N
CAS: 950859-90-2
Nombre: ethyl 5-amino-1-cyclopropylpyrazole-4-carboxylate
SMILES: CCOC(=O)C1=C(N(N=C1)C2CC2)N

Molecular Processing

Molecular formula
C9H13N3O2
Molecular weight
195.22
Exact mass
195.1008
XLogP
0.98
TPSA
70.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
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
0.556
Molar refractivity
50.87

Supplementary Information

InChIKey: IPFJFHZEMPRTSK-UHFFFAOYSA-N
Sinónimos
ethyl 5-amino-1-cyclopropyl-1H-pyrazole-4-carboxylate950859-90-2ethyl 5-amino-1-cyclopropylpyrazole-4-carboxylateSCHEMBL1407224TQP0082IPFJFHZEMPRTSK-UHFFFAOYSA-NANB85990AKOS033999866DB-142433EN300-207375G62343ethyl5-amino-1-cyclopropyl-1H-pyrazole-4-carboxylateZ1258980047ETHYL 5-(PIPERAZIN-1-YL)-1,3-THIAZOLE-4-CARBOXYLATE5-amino-1-cyclopropyl-1H-pyrazole-4-carboxylic acid ethyl ester
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