2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid

C16H15N3O3 — CID 82565577

IUPAC2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
SMILESCOCCc1nc2c(C(=O)O)ccc(-c3ccccc3)n2n1
InChIInChI=1S/C16H15N3O3/c1-22-10-9-14-17-15-12(16(20)21)7-8-13(19(15)18-14)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,20,21)
InChIKeyLACNSKRZBUDIOC-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.28
Rot. Bonds5

About 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid

2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 82565577) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
PubChem CID82565577
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
SMILESCOCCc1nc2c(C(=O)O)ccc(-c3ccccc3)n2n1
InChIInChI=1S/C16H15N3O3/c1-22-10-9-14-17-15-12(16(20)21)7-8-13(19(15)18-14)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,20,21)
InChIKeyLACNSKRZBUDIOC-UHFFFAOYSA-N
XLogP2.28
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(chloromethyl)-5-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565619
methyl 2-(2-methoxyethyl)-6-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 82565444
5-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565609
2-(2-methoxyethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboximidamide
CID 82565906
2-(2-methoxyethyl)-5-methyl-7-pyridin-3-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
CID 82565356
methyl 2-(2-methoxyethyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 82565414
2-tert-butyl-5-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565620
2-[1-(methoxymethyl)-5-phenylpyrazol-3-yl]benzoic acid
CID 135132869
2-[4-(2-methoxyethyl)phenyl]benzoic acid
CID 61025269
2-[5-[(3-hydroxyphenyl)methyl]-3-(2-methoxyethyl)-1,2,4-triazol-1-yl]benzoic acid
CID 72886228
2-methyl-5-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid
CID 82565677
2-ethyl-6-phenylpyridine-3-carboxylic acid
CID 91810897

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid (CID 82565577) is 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid is COCCc1nc2c(C(=O)O)ccc(-c3ccccc3)n2n1.
What is the InChIKey of 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is LACNSKRZBUDIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-22-10-9-14-17-15-12(16(20)21)7-8-13(19(15)18-14)11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,20,21).
What are the key properties of 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid?
2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 297.31 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 82565577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).