2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol

C13H14FN5O — CID 163254872

IUPAC2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol
SMILESCc1cc(NC(O)Cc2cn3cc(F)ccc3n2)n[nH]1
InChIInChI=1S/C13H14FN5O/c1-8-4-11(18-17-8)16-13(20)5-10-7-19-6-9(14)2-3-12(19)15-10/h2-4,6-7,13,20H,5H2,1H3,(H2,16,17,18)
InChIKeyDSIMQIZTXXDABW-UHFFFAOYSA-N
MW275.29 g/mol
LogP1.48
Rot. Bonds4

About 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol

2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol (PubChem CID 163254872) has the molecular formula C13H14FN5O and a molecular weight of 275.29 g/mol. Its IUPAC name is 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol.

Molecular Properties

Compound Name2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol
PubChem CID163254872
Molecular FormulaC13H14FN5O
Molecular Weight275.29 g/mol
Exact Mass275.12
IUPAC Name2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol
SMILESCc1cc(NC(O)Cc2cn3cc(F)ccc3n2)n[nH]1
InChIInChI=1S/C13H14FN5O/c1-8-4-11(18-17-8)16-13(20)5-10-7-19-6-9(14)2-3-12(19)15-10/h2-4,6-7,13,20H,5H2,1H3,(H2,16,17,18)
InChIKeyDSIMQIZTXXDABW-UHFFFAOYSA-N
XLogP1.48
TPSA78.24 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 51.48
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 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol?
The IUPAC name of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol (CID 163254872) is 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol.
What is the SMILES notation for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol?
The canonical SMILES for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol is Cc1cc(NC(O)Cc2cn3cc(F)ccc3n2)n[nH]1.
What is the InChIKey of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol?
The InChIKey is DSIMQIZTXXDABW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN5O/c1-8-4-11(18-17-8)16-13(20)5-10-7-19-6-9(14)2-3-12(19)15-10/h2-4,6-7,13,20H,5H2,1H3,(H2,16,17,18).
What are the key properties of 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol?
2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol has a molecular weight of 275.29 g/mol, XLogP of 1.48, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-1-[(5-methyl-1H-pyrazol-3-yl)amino]ethanol is sourced from PubChem (CID 163254872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).