5-(4-chlorophenyl)-1-ethylpyrazol-4-ol

C11H11ClN2O — CID 105480039

IUPAC5-(4-chlorophenyl)-1-ethylpyrazol-4-ol
SMILESCCn1ncc(O)c1-c1ccc(Cl)cc1
InChIInChI=1S/C11H11ClN2O/c1-2-14-11(10(15)7-13-14)8-3-5-9(12)6-4-8/h3-7,15H,2H2,1H3
InChIKeyGDNLSESDGIZRKA-UHFFFAOYSA-N
MW222.68 g/mol
LogP2.93
Rot. Bonds2

About 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol

5-(4-chlorophenyl)-1-ethylpyrazol-4-ol (PubChem CID 105480039) has the molecular formula C11H11ClN2O and a molecular weight of 222.68 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol.

Molecular Properties

Compound Name5-(4-chlorophenyl)-1-ethylpyrazol-4-ol
PubChem CID105480039
Molecular FormulaC11H11ClN2O
Molecular Weight222.68 g/mol
Exact Mass222.06
IUPAC Name5-(4-chlorophenyl)-1-ethylpyrazol-4-ol
SMILESCCn1ncc(O)c1-c1ccc(Cl)cc1
InChIInChI=1S/C11H11ClN2O/c1-2-14-11(10(15)7-13-14)8-3-5-9(12)6-4-8/h3-7,15H,2H2,1H3
InChIKeyGDNLSESDGIZRKA-UHFFFAOYSA-N
XLogP2.93
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1-ethyl-4-methylpyrazol-5-yl)phenol
CID 136765379
5-(2-chlorophenyl)-1-ethylpyrazol-4-ol
CID 105480037
5-(4-chlorophenyl)-2-ethyl-3-oxopyridazine-4-carboxylic acid
CID 82036544
1-ethyl-5-phenylpyrazol-4-amine
CID 105442691
1-ethyl-5-(4-methoxyphenyl)pyrazol-4-amine
CID 105471347
[5-(4-chlorophenyl)-3-ethyltriazol-4-yl]methanamine
CID 105498551
[4-(4-chlorophenyl)-1-methylpyrazol-5-yl]methanol
CID 89482659
1-ethylindazol-7-ol
CID 84716850
5-(4-chlorophenyl)-1-methylpyrazol-4-amine
CID 28803588
1-(4-chloro-1-ethylpyrazol-5-yl)-1-(4-chlorophenyl)-N-methylmethanamine
CID 114646347
4-amino-N-(4-chlorophenyl)-1-ethylpyrazole-5-carboxamide
CID 65357708
4-chloro-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]benzamide
CID 19290546

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol?
The IUPAC name of 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol (CID 105480039) is 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol.
What is the SMILES notation for 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol?
The canonical SMILES for 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol is CCn1ncc(O)c1-c1ccc(Cl)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol?
The InChIKey is GDNLSESDGIZRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN2O/c1-2-14-11(10(15)7-13-14)8-3-5-9(12)6-4-8/h3-7,15H,2H2,1H3.
What are the key properties of 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol?
5-(4-chlorophenyl)-1-ethylpyrazol-4-ol has a molecular weight of 222.68 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-1-ethylpyrazol-4-ol is sourced from PubChem (CID 105480039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).