[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol

C11H19N3O — CID 115092540

IUPAC[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol
SMILESCCN1CCCC1c1cc(CO)n(C)n1
InChIInChI=1S/C11H19N3O/c1-3-14-6-4-5-11(14)10-7-9(8-15)13(2)12-10/h7,11,15H,3-6,8H2,1-2H3
InChIKeyGGAQPIJVJWMVFX-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.07
Rot. Bonds3

About [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol

[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol (PubChem CID 115092540) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol.

Molecular Properties

Compound Name[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol
PubChem CID115092540
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol
SMILESCCN1CCCC1c1cc(CO)n(C)n1
InChIInChI=1S/C11H19N3O/c1-3-14-6-4-5-11(14)10-7-9(8-15)13(2)12-10/h7,11,15H,3-6,8H2,1-2H3
InChIKeyGGAQPIJVJWMVFX-UHFFFAOYSA-N
XLogP1.07
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol?
The IUPAC name of [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol (CID 115092540) is [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol.
What is the SMILES notation for [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol?
The canonical SMILES for [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol is CCN1CCCC1c1cc(CO)n(C)n1.
What is the InChIKey of [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol?
The InChIKey is GGAQPIJVJWMVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-14-6-4-5-11(14)10-7-9(8-15)13(2)12-10/h7,11,15H,3-6,8H2,1-2H3.
What are the key properties of [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol?
[3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol has a molecular weight of 209.29 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-ethylpyrrolidin-2-yl)-1-methylpyrazol-5-yl]methanol is sourced from PubChem (CID 115092540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).