5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine

C13H25N3O2Si — CID 174140306

IUPAC5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine
SMILESC[Si](C)(C)CCOCn1nc(N)cc1C1CCCO1
InChIInChI=1S/C13H25N3O2Si/c1-19(2,3)8-7-17-10-16-11(9-13(14)15-16)12-5-4-6-18-12/h9,12H,4-8,10H2,1-3H3,(H2,14,15)
InChIKeyWPPHNQJENXMLDT-UHFFFAOYSA-N
MW283.45 g/mol
LogP2.63
Rot. Bonds6

About 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine

5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine (PubChem CID 174140306) has the molecular formula C13H25N3O2Si and a molecular weight of 283.45 g/mol. Its IUPAC name is 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine.

Molecular Properties

Compound Name5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine
PubChem CID174140306
Molecular FormulaC13H25N3O2Si
Molecular Weight283.45 g/mol
Exact Mass283.17
IUPAC Name5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine
SMILESC[Si](C)(C)CCOCn1nc(N)cc1C1CCCO1
InChIInChI=1S/C13H25N3O2Si/c1-19(2,3)8-7-17-10-16-11(9-13(14)15-16)12-5-4-6-18-12/h9,12H,4-8,10H2,1-3H3,(H2,14,15)
InChIKeyWPPHNQJENXMLDT-UHFFFAOYSA-N
XLogP2.63
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.45
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine?
The IUPAC name of 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine (CID 174140306) is 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine.
What is the SMILES notation for 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine?
The canonical SMILES for 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine is C[Si](C)(C)CCOCn1nc(N)cc1C1CCCO1.
What is the InChIKey of 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine?
The InChIKey is WPPHNQJENXMLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2Si/c1-19(2,3)8-7-17-10-16-11(9-13(14)15-16)12-5-4-6-18-12/h9,12H,4-8,10H2,1-3H3,(H2,14,15).
What are the key properties of 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine?
5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine has a molecular weight of 283.45 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrazol-3-amine is sourced from PubChem (CID 174140306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).