2-(3-aminopyrazol-1-yl)ethanol

C5H9N3O — CID 21279853

IUPAC2-(3-aminopyrazol-1-yl)ethanol
SMILESNc1ccn(CCO)n1
InChIInChI=1S/C5H9N3O/c6-5-1-2-8(7-5)3-4-9/h1-2,9H,3-4H2,(H2,6,7)
InChIKeyQGJIESRUALRBPX-UHFFFAOYSA-N
MW127.15 g/mol
LogP-0.54
Rot. Bonds2

About 2-(3-aminopyrazol-1-yl)ethanol

2-(3-aminopyrazol-1-yl)ethanol (PubChem CID 21279853) has the molecular formula C5H9N3O and a molecular weight of 127.15 g/mol. Its IUPAC name is 2-(3-aminopyrazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(3-aminopyrazol-1-yl)ethanol
PubChem CID21279853
Molecular FormulaC5H9N3O
Molecular Weight127.15 g/mol
Exact Mass127.07
IUPAC Name2-(3-aminopyrazol-1-yl)ethanol
SMILESNc1ccn(CCO)n1
InChIInChI=1S/C5H9N3O/c6-5-1-2-8(7-5)3-4-9/h1-2,9H,3-4H2,(H2,6,7)
InChIKeyQGJIESRUALRBPX-UHFFFAOYSA-N
XLogP-0.54
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.15
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopyrazol-1-yl)ethanol?
The IUPAC name of 2-(3-aminopyrazol-1-yl)ethanol (CID 21279853) is 2-(3-aminopyrazol-1-yl)ethanol.
What is the SMILES notation for 2-(3-aminopyrazol-1-yl)ethanol?
The canonical SMILES for 2-(3-aminopyrazol-1-yl)ethanol is Nc1ccn(CCO)n1.
What is the InChIKey of 2-(3-aminopyrazol-1-yl)ethanol?
The InChIKey is QGJIESRUALRBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O/c6-5-1-2-8(7-5)3-4-9/h1-2,9H,3-4H2,(H2,6,7).
What are the key properties of 2-(3-aminopyrazol-1-yl)ethanol?
2-(3-aminopyrazol-1-yl)ethanol has a molecular weight of 127.15 g/mol, XLogP of -0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopyrazol-1-yl)ethanol is sourced from PubChem (CID 21279853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).