4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol

C19H16N4O — CID 141301377

IUPAC4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol
SMILESCc1cc(O)ccc1-c1ccc2nc(Nc3ccccc3)nn2c1
InChIInChI=1S/C19H16N4O/c1-13-11-16(24)8-9-17(13)14-7-10-18-21-19(22-23(18)12-14)20-15-5-3-2-4-6-15/h2-12,24H,1H3,(H,20,22)
InChIKeySRHBNEOWLFXWPS-UHFFFAOYSA-N
MW316.36 g/mol
LogP4.15
Rot. Bonds3

About 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol

4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol (PubChem CID 141301377) has the molecular formula C19H16N4O and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol.

Molecular Properties

Compound Name4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol
PubChem CID141301377
Molecular FormulaC19H16N4O
Molecular Weight316.36 g/mol
Exact Mass316.13
IUPAC Name4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol
SMILESCc1cc(O)ccc1-c1ccc2nc(Nc3ccccc3)nn2c1
InChIInChI=1S/C19H16N4O/c1-13-11-16(24)8-9-17(13)14-7-10-18-21-19(22-23(18)12-14)20-15-5-3-2-4-6-15/h2-12,24H,1H3,(H,20,22)
InChIKeySRHBNEOWLFXWPS-UHFFFAOYSA-N
XLogP4.15
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[(6-hydroxy-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]benzoate
CID 110455111
1-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]-3-phenylurea
CID 53234900
1-(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-3-phenylurea
CID 110472243
2-[3-[[6-(2-chloro-5-hydroxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]phenoxy]acetamide;4-chloro-3-[2-[4-(trifluoromethoxy)anilino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenol
CID 158873879
2-anilino-4,6-dimethylpyrimidin-5-ol
CID 45097442
4-chloro-3-[2-[[6-(2-pyrrolidin-1-ylethoxy)-3-pyridinyl]amino]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenol
CID 54755443
N-[2-[2-(2-cyanoanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]acetamide
CID 67216719
N-[6-(4-hydroxy-3,5-dimethylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]pyridine-3-carboxamide
CID 59437440
5-(4-aminophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 59276560
5-(4-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 59186476
1-[2-[[5-[[6-(2-chloro-5-hydroxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]oxy]ethyl]pyrrolidin-2-one
CID 54769557
N-[3-[2-(2-methoxyanilino)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]phenyl]methanesulfonamide
CID 67216303

Frequently Asked Questions

What is the IUPAC name of 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol?
The IUPAC name of 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol (CID 141301377) is 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol.
What is the SMILES notation for 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol?
The canonical SMILES for 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol is Cc1cc(O)ccc1-c1ccc2nc(Nc3ccccc3)nn2c1.
What is the InChIKey of 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol?
The InChIKey is SRHBNEOWLFXWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O/c1-13-11-16(24)8-9-17(13)14-7-10-18-21-19(22-23(18)12-14)20-15-5-3-2-4-6-15/h2-12,24H,1H3,(H,20,22).
What are the key properties of 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol?
4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol has a molecular weight of 316.36 g/mol, XLogP of 4.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-anilino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methylphenol is sourced from PubChem (CID 141301377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).