methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate

C10H10N4O2 — CID 86250027

IUPACmethyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate
SMILESCOC(=O)c1cc(N)n(-c2ccccn2)n1
InChIInChI=1S/C10H10N4O2/c1-16-10(15)7-6-8(11)14(13-7)9-4-2-3-5-12-9/h2-6H,11H2,1H3
InChIKeyMQSDGNTYAXTNIW-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.64
Rot. Bonds2

About methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate

methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate (PubChem CID 86250027) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate.

Molecular Properties

Compound Namemethyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate
PubChem CID86250027
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Namemethyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate
SMILESCOC(=O)c1cc(N)n(-c2ccccn2)n1
InChIInChI=1S/C10H10N4O2/c1-16-10(15)7-6-8(11)14(13-7)9-4-2-3-5-12-9/h2-6H,11H2,1H3
InChIKeyMQSDGNTYAXTNIW-UHFFFAOYSA-N
XLogP0.64
TPSA83.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-tert-butyl-1-pyridin-2-ylpyrazol-5-amine
CID 43381330
methyl 1-(6-chloropyridazin-3-yl)-5-pyridin-2-ylpyrazole-3-carboxylate
CID 23143755
methyl 5-amino-1-(3-chloro-4-fluorophenyl)pyrazole-3-carboxylate
CID 82305712
dimethyl 5-aminopyrazole-1,3-dicarboxylate
CID 163321502
ethyl 5-amino-1-phenylpyrazole-3-carboxylate
CID 23630921
5-amino-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
CID 135371375
1-(5-propan-2-yl-1-pyridin-2-ylpyrazol-3-yl)ethanone
CID 170580254
methyl 3-oxo-2-pyridin-2-yl-1H-pyrazole-5-carboxylate
CID 102143711
methyl 2-amino-5-(4-pyridin-2-ylpiperazin-1-yl)benzoate
CID 146347076
dimethyl 1-(2-aminobenzoyl)pyrazole-3,5-dicarboxylate
CID 13290788
5-methoxy-2-pyridin-2-yl-1,2,4-triazol-3-amine
CID 79872887
3-(4-chlorophenyl)-1-pyridin-2-ylpyrazol-5-amine
CID 43381333

Frequently Asked Questions

What is the IUPAC name of methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate?
The IUPAC name of methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate (CID 86250027) is methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate.
What is the SMILES notation for methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate?
The canonical SMILES for methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate is COC(=O)c1cc(N)n(-c2ccccn2)n1.
What is the InChIKey of methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate?
The InChIKey is MQSDGNTYAXTNIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-16-10(15)7-6-8(11)14(13-7)9-4-2-3-5-12-9/h2-6H,11H2,1H3.
What are the key properties of methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate?
methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate has a molecular weight of 218.22 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 5-amino-1-pyridin-2-ylpyrazole-3-carboxylate is sourced from PubChem (CID 86250027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).