2-(4,5-diaminopyrazol-1-yl)ethanol

C5H10N4O — CID 10290847

IUPAC2-(4,5-diaminopyrazol-1-yl)ethanol
SMILESNc1cnn(CCO)c1N
InChIInChI=1S/C5H10N4O/c6-4-3-8-9(1-2-10)5(4)7/h3,10H,1-2,6-7H2
InChIKeyKDBUTNSQYYLYOY-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.96
Rot. Bonds2

About 2-(4,5-diaminopyrazol-1-yl)ethanol

2-(4,5-diaminopyrazol-1-yl)ethanol (PubChem CID 10290847) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 2-(4,5-diaminopyrazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(4,5-diaminopyrazol-1-yl)ethanol
PubChem CID10290847
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name2-(4,5-diaminopyrazol-1-yl)ethanol
SMILESNc1cnn(CCO)c1N
InChIInChI=1S/C5H10N4O/c6-4-3-8-9(1-2-10)5(4)7/h3,10H,1-2,6-7H2
InChIKeyKDBUTNSQYYLYOY-UHFFFAOYSA-N
XLogP-0.96
TPSA90.09 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-diaminopyrazol-1-yl)ethanol?
The IUPAC name of 2-(4,5-diaminopyrazol-1-yl)ethanol (CID 10290847) is 2-(4,5-diaminopyrazol-1-yl)ethanol.
What is the SMILES notation for 2-(4,5-diaminopyrazol-1-yl)ethanol?
The canonical SMILES for 2-(4,5-diaminopyrazol-1-yl)ethanol is Nc1cnn(CCO)c1N.
What is the InChIKey of 2-(4,5-diaminopyrazol-1-yl)ethanol?
The InChIKey is KDBUTNSQYYLYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c6-4-3-8-9(1-2-10)5(4)7/h3,10H,1-2,6-7H2.
What are the key properties of 2-(4,5-diaminopyrazol-1-yl)ethanol?
2-(4,5-diaminopyrazol-1-yl)ethanol has a molecular weight of 142.16 g/mol, XLogP of -0.96, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-diaminopyrazol-1-yl)ethanol is sourced from PubChem (CID 10290847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).