ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate

C10H15N3O2 — CID 25247540

IUPACethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate
SMILESCCOC(=O)Cn1nc(C2CC2)cc1N
InChIInChI=1S/C10H15N3O2/c1-2-15-10(14)6-13-9(11)5-8(12-13)7-3-4-7/h5,7H,2-4,6,11H2,1H3
InChIKeyZJWAHWMOOZTVAZ-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.91
Rot. Bonds4

About ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate

ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate (PubChem CID 25247540) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate
PubChem CID25247540
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Nameethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate
SMILESCCOC(=O)Cn1nc(C2CC2)cc1N
InChIInChI=1S/C10H15N3O2/c1-2-15-10(14)6-13-9(11)5-8(12-13)7-3-4-7/h5,7H,2-4,6,11H2,1H3
InChIKeyZJWAHWMOOZTVAZ-UHFFFAOYSA-N
XLogP0.91
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate?
The IUPAC name of ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate (CID 25247540) is ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate.
What is the SMILES notation for ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate?
The canonical SMILES for ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate is CCOC(=O)Cn1nc(C2CC2)cc1N.
What is the InChIKey of ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate?
The InChIKey is ZJWAHWMOOZTVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-2-15-10(14)6-13-9(11)5-8(12-13)7-3-4-7/h5,7H,2-4,6,11H2,1H3.
What are the key properties of ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate?
ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate has a molecular weight of 209.25 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(5-amino-3-cyclopropylpyrazol-1-yl)acetate is sourced from PubChem (CID 25247540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).