4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol

C22H19N3O2 — CID 135693427

IUPAC4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol
SMILESCCc1c(-c2ccc(O)cc2)nn(-c2ccccn2)c1-c1ccc(O)cc1
InChIInChI=1S/C22H19N3O2/c1-2-19-21(15-6-10-17(26)11-7-15)24-25(20-5-3-4-14-23-20)22(19)16-8-12-18(27)13-9-16/h3-14,26-27H,2H2,1H3
InChIKeyOIEYHDFRZGMXDY-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.57
Rot. Bonds4

About 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol

4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol (PubChem CID 135693427) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol.

Molecular Properties

Compound Name4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol
PubChem CID135693427
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol
SMILESCCc1c(-c2ccc(O)cc2)nn(-c2ccccn2)c1-c1ccc(O)cc1
InChIInChI=1S/C22H19N3O2/c1-2-19-21(15-6-10-17(26)11-7-15)24-25(20-5-3-4-14-23-20)22(19)16-8-12-18(27)13-9-16/h3-14,26-27H,2H2,1H3
InChIKeyOIEYHDFRZGMXDY-UHFFFAOYSA-N
XLogP4.57
TPSA71.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-ethyl-3-(4-hydroxyphenyl)-1-[2-(trifluoromethyl)phenyl]pyrazol-5-yl]phenol
CID 135693271
4-[1-(3,5-dichlorophenyl)-4-ethyl-3-(4-hydroxyphenyl)pyrazol-5-yl]phenol
CID 135693404
4-[3-(4-hydroxyphenyl)-1-phenyl-4-propylpyrazol-5-yl]phenol
CID 135494350
4-[4-ethyl-3-(4-hydroxyphenyl)-1-(2-methylpropyl)pyrazol-5-yl]phenol
CID 135693268
4-ethyl-3,5-bis(4-methoxyphenyl)-1-phenylpyrazole
CID 19586817
4-[4-(2-methylpropyl)-1,3-diphenylpyrazol-5-yl]phenol
CID 135430134
4-ethyl-1-methyl-3,5-diphenylpyrazole
CID 21441230
4-[4-ethyl-3-(4-hydroxyphenyl)-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrazol-5-yl]phenol
CID 138740429
5-(4-ethoxyphenyl)-3-methyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
CID 82072302
5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
CID 90747187
4-ethyl-1-(4-methoxyphenyl)-3,5-diphenylpyrazole
CID 10808049
4-[4-ethyl-3-(4-hydroxyphenyl)-1-(4-methylphenyl)sulfonylpyrazol-5-yl]phenol
CID 135693305

Frequently Asked Questions

What is the IUPAC name of 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol?
The IUPAC name of 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol (CID 135693427) is 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol.
What is the SMILES notation for 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol?
The canonical SMILES for 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol is CCc1c(-c2ccc(O)cc2)nn(-c2ccccn2)c1-c1ccc(O)cc1.
What is the InChIKey of 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol?
The InChIKey is OIEYHDFRZGMXDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-2-19-21(15-6-10-17(26)11-7-15)24-25(20-5-3-4-14-23-20)22(19)16-8-12-18(27)13-9-16/h3-14,26-27H,2H2,1H3.
What are the key properties of 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol?
4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol has a molecular weight of 357.41 g/mol, XLogP of 4.57, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-ethyl-3-(4-hydroxyphenyl)-1-pyridin-2-ylpyrazol-5-yl]phenol is sourced from PubChem (CID 135693427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).