1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol

C13H15N5O — CID 81445036

IUPAC1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol
SMILESCc1cccn2cc(Cn3cc(C(C)O)nn3)nc12
InChIInChI=1S/C13H15N5O/c1-9-4-3-5-17-6-11(14-13(9)17)7-18-8-12(10(2)19)15-16-18/h3-6,8,10,19H,7H2,1-2H3
InChIKeyKDJAPFJLGMYFME-UHFFFAOYSA-N
MW257.30 g/mol
LogP1.34
Rot. Bonds3

About 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol

1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol (PubChem CID 81445036) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol
PubChem CID81445036
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC Name1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol
SMILESCc1cccn2cc(Cn3cc(C(C)O)nn3)nc12
InChIInChI=1S/C13H15N5O/c1-9-4-3-5-17-6-11(14-13(9)17)7-18-8-12(10(2)19)15-16-18/h3-6,8,10,19H,7H2,1-2H3
InChIKeyKDJAPFJLGMYFME-UHFFFAOYSA-N
XLogP1.34
TPSA68.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol?
The IUPAC name of 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol (CID 81445036) is 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol.
What is the SMILES notation for 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol?
The canonical SMILES for 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol is Cc1cccn2cc(Cn3cc(C(C)O)nn3)nc12.
What is the InChIKey of 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol?
The InChIKey is KDJAPFJLGMYFME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c1-9-4-3-5-17-6-11(14-13(9)17)7-18-8-12(10(2)19)15-16-18/h3-6,8,10,19H,7H2,1-2H3.
What are the key properties of 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol?
1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol has a molecular weight of 257.30 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]ethanol is sourced from PubChem (CID 81445036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).