2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol

C16H15N3O2 — CID 2999618

IUPAC2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol
SMILESCc1nn(-c2ccccn2)c(C)c1Oc1ccccc1O
InChIInChI=1S/C16H15N3O2/c1-11-16(21-14-8-4-3-7-13(14)20)12(2)19(18-11)15-9-5-6-10-17-15/h3-10,20H,1-2H3
InChIKeyCIOLMZNHBLSEHW-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.38
Rot. Bonds3

About 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol

2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol (PubChem CID 2999618) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol.

Molecular Properties

Compound Name2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol
PubChem CID2999618
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol
SMILESCc1nn(-c2ccccn2)c(C)c1Oc1ccccc1O
InChIInChI=1S/C16H15N3O2/c1-11-16(21-14-8-4-3-7-13(14)20)12(2)19(18-11)15-9-5-6-10-17-15/h3-10,20H,1-2H3
InChIKeyCIOLMZNHBLSEHW-UHFFFAOYSA-N
XLogP3.38
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3,5-dimethyl-1H-pyrazol-1-yl)-6-(2-methoxyphenoxy)pyrimidine
CID 850354
2-{[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]oxy}phenol
CID 876620
Ipp/cnrs-A019
CID 118430525
2-[3,5-Dimethyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazol-4-yl]oxyphenol
CID 4465636
(NZ)-N-[3-(5-methyl-1-phenylpyrazol-4-yl)pyrido[3,2-b][1,4]oxazin-2-ylidene]hydroxylamine
CID 137660504
2-[4-(2,6-Difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]-3-fluoro-5-propylpyridine
CID 118430417
2-[4-(2,6-Difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]-5-ethylpyridine
CID 118430450
5-Cyclopropyl-2-[4-(2,4-difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]pyridine
CID 118430451
5-Cyclopropyl-2-[4-(2,6-difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]pyridin-3-ol
CID 118430473
2-[4-(2,6-Difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]-5-methoxypyrazine
CID 118430477
5-Cyclopropyl-2-[3-ethoxy-4-(2-fluorophenoxy)-5-methylpyrazol-1-yl]pyridine
CID 118430493
2-[6-[4-(2,6-Difluorophenoxy)-5-methyl-3-propan-2-yloxypyrazol-1-yl]-3-pyridinyl]propan-2-ol
CID 118430522

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol?
The IUPAC name of 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol (CID 2999618) is 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol.
What is the SMILES notation for 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol?
The canonical SMILES for 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol is Cc1nn(-c2ccccn2)c(C)c1Oc1ccccc1O.
What is the InChIKey of 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol?
The InChIKey is CIOLMZNHBLSEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-11-16(21-14-8-4-3-7-13(14)20)12(2)19(18-11)15-9-5-6-10-17-15/h3-10,20H,1-2H3.
What are the key properties of 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol?
2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol has a molecular weight of 281.31 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1-pyridin-2-ylpyrazol-4-yl)oxyphenol is sourced from PubChem (CID 2999618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).