5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol

C18H11F2N3O2 — CID 170685650

IUPAC5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol
SMILESOc1cncc(-c2ccc3c(cnn3-c3cc(O)c(F)c(F)c3)c2)c1
InChIInChI=1S/C18H11F2N3O2/c19-15-5-13(6-17(25)18(15)20)23-16-2-1-10(3-12(16)8-22-23)11-4-14(24)9-21-7-11/h1-9,24-25H
InChIKeyCCLNQAOCUZAYMB-UHFFFAOYSA-N
MW339.30 g/mol
LogP3.78
Rot. Bonds2

About 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol

5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol (PubChem CID 170685650) has the molecular formula C18H11F2N3O2 and a molecular weight of 339.30 g/mol. Its IUPAC name is 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol.

Molecular Properties

Compound Name5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol
PubChem CID170685650
Molecular FormulaC18H11F2N3O2
Molecular Weight339.30 g/mol
Exact Mass339.08
IUPAC Name5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol
SMILESOc1cncc(-c2ccc3c(cnn3-c3cc(O)c(F)c(F)c3)c2)c1
InChIInChI=1S/C18H11F2N3O2/c19-15-5-13(6-17(25)18(15)20)23-16-2-1-10(3-12(16)8-22-23)11-4-14(24)9-21-7-11/h1-9,24-25H
InChIKeyCCLNQAOCUZAYMB-UHFFFAOYSA-N
XLogP3.78
TPSA71.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.30
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-(4-Fluorophenyl)indazol-5-yl]phenol
CID 46831087
3-[1-(4-Fluorophenyl)indazol-5-yl]phenol
CID 46831397
5-[(1-Methyl-3-phenylpyrazol-5-yl)methyl]pyridin-3-ol
CID 145980859
3-Fluoro-4-[5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridin-3-yl]phenol
CID 162650467
(S)-1-(6-(2-(4-(trifluoromethyl)benzyl)-2H-indazol-5-yl)pyridin-2-yl)ethane-1,2-diol
CID 118414385
1H-Indazol-4-ol, 1-phenyl-5-(phenylmethyl)-
CID 135705548
4-(1-Phenylpyrazol-4-yl)quinolin-7-ol
CID 136254191
2,3-Difluoro-5-(5-(6-methylpyridin-3-yl)-1H-indazol-1-yl)phenol
CID 163233832
2-Fluoro-5-(5-(4-methoxyphenyl)-1H-indazol-1-yl)phenol
CID 163233868
2-Fluoro-5-(5-(4-hydroxyphenyl)-1H-indazol-1-yl)phenol
CID 163233888
2-Fluoro-5-(5-(o-tolyl)-1H-indazol-1-yl)phenol
CID 163233905
5-(5-(4,4-Dimethylcyclohex-1-en-1-yl)-2H-indazol-2-yl)-2-fluoro-3-(trifluoromethyl)phenol
CID 163233938

Frequently Asked Questions

What is the IUPAC name of 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol?
The IUPAC name of 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol (CID 170685650) is 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol.
What is the SMILES notation for 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol?
The canonical SMILES for 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol is Oc1cncc(-c2ccc3c(cnn3-c3cc(O)c(F)c(F)c3)c2)c1.
What is the InChIKey of 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol?
The InChIKey is CCLNQAOCUZAYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F2N3O2/c19-15-5-13(6-17(25)18(15)20)23-16-2-1-10(3-12(16)8-22-23)11-4-14(24)9-21-7-11/h1-9,24-25H.
What are the key properties of 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol?
5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol has a molecular weight of 339.30 g/mol, XLogP of 3.78, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(3,4-difluoro-5-hydroxyphenyl)indazol-5-yl]pyridin-3-ol is sourced from PubChem (CID 170685650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).