2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol

C9H11N3O2 — CID 55269055

IUPAC2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol
SMILESNc1cnn(CC(O)c2ccco2)c1
InChIInChI=1S/C9H11N3O2/c10-7-4-11-12(5-7)6-8(13)9-2-1-3-14-9/h1-5,8,13H,6,10H2
InChIKeyTWGOJPOBOMJRCR-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.79
Rot. Bonds3

About 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol

2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol (PubChem CID 55269055) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol
PubChem CID55269055
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol
SMILESNc1cnn(CC(O)c2ccco2)c1
InChIInChI=1S/C9H11N3O2/c10-7-4-11-12(5-7)6-8(13)9-2-1-3-14-9/h1-5,8,13H,6,10H2
InChIKeyTWGOJPOBOMJRCR-UHFFFAOYSA-N
XLogP0.79
TPSA77.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol (CID 55269055) is 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol is Nc1cnn(CC(O)c2ccco2)c1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
The InChIKey is TWGOJPOBOMJRCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c10-7-4-11-12(5-7)6-8(13)9-2-1-3-14-9/h1-5,8,13H,6,10H2.
What are the key properties of 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol?
2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol has a molecular weight of 193.21 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-1-(furan-2-yl)ethanol is sourced from PubChem (CID 55269055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).