[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol

C8H10N4O — CID 69031978

IUPAC[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol
SMILESNc1c(NCO)nn2ccccc12
InChIInChI=1S/C8H10N4O/c9-7-6-3-1-2-4-12(6)11-8(7)10-5-13/h1-4,13H,5,9H2,(H,10,11)
InChIKeyBZCWSAIBYPEHRQ-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.28
Rot. Bonds2

About [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol

[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol (PubChem CID 69031978) has the molecular formula C8H10N4O and a molecular weight of 178.19 g/mol. Its IUPAC name is [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol.

Molecular Properties

Compound Name[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol
PubChem CID69031978
Molecular FormulaC8H10N4O
Molecular Weight178.19 g/mol
Exact Mass178.09
IUPAC Name[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol
SMILESNc1c(NCO)nn2ccccc12
InChIInChI=1S/C8H10N4O/c9-7-6-3-1-2-4-12(6)11-8(7)10-5-13/h1-4,13H,5,9H2,(H,10,11)
InChIKeyBZCWSAIBYPEHRQ-UHFFFAOYSA-N
XLogP0.28
TPSA75.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol?
The IUPAC name of [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol (CID 69031978) is [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol.
What is the SMILES notation for [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol?
The canonical SMILES for [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol is Nc1c(NCO)nn2ccccc12.
What is the InChIKey of [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol?
The InChIKey is BZCWSAIBYPEHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c9-7-6-3-1-2-4-12(6)11-8(7)10-5-13/h1-4,13H,5,9H2,(H,10,11).
What are the key properties of [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol?
[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol has a molecular weight of 178.19 g/mol, XLogP of 0.28, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]methanol is sourced from PubChem (CID 69031978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).