2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol

C15H14N4O — CID 171716324

IUPAC2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol
SMILESCCc1nc(-c2ccccc2O)n(-c2ccccn2)n1
InChIInChI=1S/C15H14N4O/c1-2-13-17-15(11-7-3-4-8-12(11)20)19(18-13)14-9-5-6-10-16-14/h3-10,20H,2H2,1H3
InChIKeyYCBUSDWLCVAESN-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.60
Rot. Bonds3

About 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol

2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol (PubChem CID 171716324) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol.

Molecular Properties

Compound Name2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol
PubChem CID171716324
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol
SMILESCCc1nc(-c2ccccc2O)n(-c2ccccn2)n1
InChIInChI=1S/C15H14N4O/c1-2-13-17-15(11-7-3-4-8-12(11)20)19(18-13)14-9-5-6-10-16-14/h3-10,20H,2H2,1H3
InChIKeyYCBUSDWLCVAESN-UHFFFAOYSA-N
XLogP2.60
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-phenyl-5-propyl-1,2,4-triazol-3-yl)phenol
CID 877391
5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
CID 90747187
2-[5-(2H-benzotriazol-4-yl)-1-pyridin-2-yl-1,2,4-triazol-3-yl]acetamide
CID 154818129
2,3-dimethyl-5-[5-(2-methylpropyl)-2-pyridin-2-yl-1,2,4-triazol-3-yl]benzenesulfonamide
CID 50976916
2-(3,5-dimethylpyrazol-1-yl)pyridine
CID 676764
2-(3-ethoxy-5-methylpyrazol-1-yl)pyridine
CID 101498728
4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol
CID 135693427
ethane;2-(5-methylpyrazol-1-yl)pyridine
CID 90883598
2-pyridin-2-ylphenol;hydrate
CID 175244966
2-(3-tert-butyl-5-methylpyrazol-1-yl)pyridine
CID 123989835
2-[5-(methylsulfonylmethyl)-3-(2-phenylethyl)-1,2,4-triazol-1-yl]pyridine
CID 50970750
2-[5-(2,4-difluoro-3-methoxyphenyl)-3-methyl-1,2,4-triazol-1-yl]pyridine
CID 50950919

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol?
The IUPAC name of 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol (CID 171716324) is 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol.
What is the SMILES notation for 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol?
The canonical SMILES for 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol is CCc1nc(-c2ccccc2O)n(-c2ccccn2)n1.
What is the InChIKey of 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol?
The InChIKey is YCBUSDWLCVAESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-2-13-17-15(11-7-3-4-8-12(11)20)19(18-13)14-9-5-6-10-16-14/h3-10,20H,2H2,1H3.
What are the key properties of 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol?
2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol has a molecular weight of 266.30 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2-pyridin-2-yl-1,2,4-triazol-3-yl)phenol is sourced from PubChem (CID 171716324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).