5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole

C10H9FN2O — CID 70662601

IUPAC5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole
SMILESCOc1cc(-c2ccn[nH]2)ccc1F
InChIInChI=1S/C10H9FN2O/c1-14-10-6-7(2-3-8(10)11)9-4-5-12-13-9/h2-6H,1H3,(H,12,13)
InChIKeyHHPWLCWRGJWVKJ-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.22
Rot. Bonds2

About 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole

5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole (PubChem CID 70662601) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole
PubChem CID70662601
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole
SMILESCOc1cc(-c2ccn[nH]2)ccc1F
InChIInChI=1S/C10H9FN2O/c1-14-10-6-7(2-3-8(10)11)9-4-5-12-13-9/h2-6H,1H3,(H,12,13)
InChIKeyHHPWLCWRGJWVKJ-UHFFFAOYSA-N
XLogP2.22
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole (CID 70662601) is 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole is COc1cc(-c2ccn[nH]2)ccc1F.
What is the InChIKey of 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole?
The InChIKey is HHPWLCWRGJWVKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-10-6-7(2-3-8(10)11)9-4-5-12-13-9/h2-6H,1H3,(H,12,13).
What are the key properties of 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole?
5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole has a molecular weight of 192.19 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluoro-3-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 70662601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).