4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol

C13H9ClN2O2 — CID 5068970

IUPAC4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol
SMILESOc1ccc(Cl)cc1-c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C13H9ClN2O2/c14-8-3-4-12(17)9(6-8)10-7-11(16-15-10)13-2-1-5-18-13/h1-7,17H,(H,15,16)
InChIKeyDBFZTTDBQHHVGE-UHFFFAOYSA-N
MW260.68 g/mol
LogP3.70
Rot. Bonds2

About 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol

4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol (PubChem CID 5068970) has the molecular formula C13H9ClN2O2 and a molecular weight of 260.68 g/mol. Its IUPAC name is 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol.

Molecular Properties

Compound Name4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol
PubChem CID5068970
Molecular FormulaC13H9ClN2O2
Molecular Weight260.68 g/mol
Exact Mass260.04
IUPAC Name4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol
SMILESOc1ccc(Cl)cc1-c1cc(-c2ccco2)[nH]n1
InChIInChI=1S/C13H9ClN2O2/c14-8-3-4-12(17)9(6-8)10-7-11(16-15-10)13-2-1-5-18-13/h1-7,17H,(H,15,16)
InChIKeyDBFZTTDBQHHVGE-UHFFFAOYSA-N
XLogP3.70
TPSA62.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.68
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-(furan-2-yl)-1H-pyrazol-3-yl)naphthalen-1-ol
CID 719865
4-bromo-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol
CID 4407147
2-[5-(2-Furyl)-1H-pyrazol-3-yl]phenol
CID 614686
3-(2-Furyl)-N'-(1-(4-hydroxyphenyl)ethylidene)-1H-pyrazole-5-carbohydrazide
CID 135438887
3-(2-ethoxyphenyl)-1H-pyrazole-5-carboxylic acid
CID 3159738
5-(furan-2-yl)-3-phenyl-1H-pyrazole
CID 835422
3-(furan-3-yl)-1H-pyrazole-5-carboxylic acid
CID 39870608
2-(3-(Furan-2-YL)-1H-pyrazol-5-YL)aniline
CID 10823070
3-(5-chloro-2-methoxyphenyl)-N-(furan-2-ylmethyl)-1H-pyrazole-5-carboxamide
CID 46948510
methyl 3-(5-chloro-3-methyl-1-benzofuran-2-yl)-1H-pyrazole-5-carboxylate
CID 155551479
1-[3-(furan-3-yl)-1H-pyrazol-5-yl]ethane-1,2-diol
CID 155563594
5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-ol
CID 170556869

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol?
The IUPAC name of 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol (CID 5068970) is 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol.
What is the SMILES notation for 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol?
The canonical SMILES for 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol is Oc1ccc(Cl)cc1-c1cc(-c2ccco2)[nH]n1.
What is the InChIKey of 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol?
The InChIKey is DBFZTTDBQHHVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClN2O2/c14-8-3-4-12(17)9(6-8)10-7-11(16-15-10)13-2-1-5-18-13/h1-7,17H,(H,15,16).
What are the key properties of 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol?
4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol has a molecular weight of 260.68 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[5-(furan-2-yl)-1H-pyrazol-3-yl]phenol is sourced from PubChem (CID 5068970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).