[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol

C16H14N6O — CID 166401701

IUPAC[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol
SMILESOCc1ccc(-c2cn(Cc3cn4ccccc4n3)nn2)cn1
InChIInChI=1S/C16H14N6O/c23-11-13-5-4-12(7-17-13)15-10-22(20-19-15)9-14-8-21-6-2-1-3-16(21)18-14/h1-8,10,23H,9,11H2
InChIKeyGSNJOUZOTNLUAF-UHFFFAOYSA-N
MW306.33 g/mol
LogP1.53
Rot. Bonds4

About [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol

[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol (PubChem CID 166401701) has the molecular formula C16H14N6O and a molecular weight of 306.33 g/mol. Its IUPAC name is [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol
PubChem CID166401701
Molecular FormulaC16H14N6O
Molecular Weight306.33 g/mol
Exact Mass306.12
IUPAC Name[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol
SMILESOCc1ccc(-c2cn(Cc3cn4ccccc4n3)nn2)cn1
InChIInChI=1S/C16H14N6O/c23-11-13-5-4-12(7-17-13)15-10-22(20-19-15)9-14-8-21-6-2-1-3-16(21)18-14/h1-8,10,23H,9,11H2
InChIKeyGSNJOUZOTNLUAF-UHFFFAOYSA-N
XLogP1.53
TPSA81.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]methanol
CID 55066990
methyl 1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazole-4-carboxylate
CID 113231454
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
1-benzyl-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)triazole-4-carboxamide
CID 37089479
methyl 1-(imidazo[1,2-a]pyridin-2-ylmethyl)-1,2,4-triazole-3-carboxylate
CID 78955690
2-[[4-[5-(dimethylamino)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 171084299
imidazo[1,2-a]pyridin-2-ylmethylazanium
CID 7012186
1-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]ethanamine
CID 105359666
1-(imidazo[1,2-a]pyridin-2-ylmethyl)imidazole-4-carbaldehyde
CID 106716817
pyrrolo[1,2-a]pyrazin-3-ylmethanol
CID 175653982
1-benzyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrazole-4-carboxamide
CID 9185448
N-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrazol-4-yl]-5-methylpyrazine-2-carboxamide
CID 51105950

Frequently Asked Questions

What is the IUPAC name of [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol?
The IUPAC name of [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol (CID 166401701) is [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol.
What is the SMILES notation for [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol?
The canonical SMILES for [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol is OCc1ccc(-c2cn(Cc3cn4ccccc4n3)nn2)cn1.
What is the InChIKey of [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol?
The InChIKey is GSNJOUZOTNLUAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6O/c23-11-13-5-4-12(7-17-13)15-10-22(20-19-15)9-14-8-21-6-2-1-3-16(21)18-14/h1-8,10,23H,9,11H2.
What are the key properties of [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol?
[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol has a molecular weight of 306.33 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol is sourced from PubChem (CID 166401701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).