2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol

C11H16N4O2 — CID 12011929

IUPAC2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol
SMILESNc1cnn2c(N(CCO)CCO)cccc12
InChIInChI=1S/C11H16N4O2/c12-9-8-13-15-10(9)2-1-3-11(15)14(4-6-16)5-7-17/h1-3,8,16-17H,4-7,12H2
InChIKeyMXEDEJATTOLFHL-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.29
Rot. Bonds5

About 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol

2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol (PubChem CID 12011929) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol
PubChem CID12011929
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol
SMILESNc1cnn2c(N(CCO)CCO)cccc12
InChIInChI=1S/C11H16N4O2/c12-9-8-13-15-10(9)2-1-3-11(15)14(4-6-16)5-7-17/h1-3,8,16-17H,4-7,12H2
InChIKeyMXEDEJATTOLFHL-UHFFFAOYSA-N
XLogP-0.29
TPSA87.02 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol (CID 12011929) is 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol is Nc1cnn2c(N(CCO)CCO)cccc12.
What is the InChIKey of 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol?
The InChIKey is MXEDEJATTOLFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c12-9-8-13-15-10(9)2-1-3-11(15)14(4-6-16)5-7-17/h1-3,8,16-17H,4-7,12H2.
What are the key properties of 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol?
2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol has a molecular weight of 236.27 g/mol, XLogP of -0.29, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-aminopyrazolo[1,5-a]pyridin-7-yl)-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 12011929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).