2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile

C14H10N4O — CID 82567167

IUPAC2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
SMILESCOc1cccc(-c2nc3cc(C#N)ccn3n2)c1
InChIInChI=1S/C14H10N4O/c1-19-12-4-2-3-11(8-12)14-16-13-7-10(9-15)5-6-18(13)17-14/h2-8H,1H3
InChIKeyUFOSULANLSRBMI-UHFFFAOYSA-N
MW250.26 g/mol
LogP2.28
Rot. Bonds2

About 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile

2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile (PubChem CID 82567167) has the molecular formula C14H10N4O and a molecular weight of 250.26 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
PubChem CID82567167
Molecular FormulaC14H10N4O
Molecular Weight250.26 g/mol
Exact Mass250.09
IUPAC Name2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
SMILESCOc1cccc(-c2nc3cc(C#N)ccn3n2)c1
InChIInChI=1S/C14H10N4O/c1-19-12-4-2-3-11(8-12)14-16-13-7-10(9-15)5-6-18(13)17-14/h2-8H,1H3
InChIKeyUFOSULANLSRBMI-UHFFFAOYSA-N
XLogP2.28
TPSA63.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-tert-butylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
CID 82567186
2-(3,5-difluorophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
CID 82567201
3-(3-methoxyphenyl)benzonitrile
CID 4189594
2-(3,5-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbonitrile
CID 82567315
2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-6-ol
CID 117130737
2-thiophen-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
CID 82567151
8-bromo-2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117137616
2-(7-methoxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 136927173
2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060343
4-(7-acetyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)benzonitrile
CID 176614135
5-chloro-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbonitrile
CID 82342890
3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenol
CID 82566326

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The IUPAC name of 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile (CID 82567167) is 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile.
What is the SMILES notation for 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The canonical SMILES for 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile is COc1cccc(-c2nc3cc(C#N)ccn3n2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
The InChIKey is UFOSULANLSRBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O/c1-19-12-4-2-3-11(8-12)14-16-13-7-10(9-15)5-6-18(13)17-14/h2-8H,1H3.
What are the key properties of 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile?
2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile has a molecular weight of 250.26 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile is sourced from PubChem (CID 82567167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).