4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole

C10H9FN2O — CID 130466751

IUPAC4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole
SMILESCOc1cc(F)ccc1-c1cn[nH]c1
InChIInChI=1S/C10H9FN2O/c1-14-10-4-8(11)2-3-9(10)7-5-12-13-6-7/h2-6H,1H3,(H,12,13)
InChIKeyWMGKHQMZSGGTAQ-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.22
Rot. Bonds2

About 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole

4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole (PubChem CID 130466751) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole
PubChem CID130466751
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole
SMILESCOc1cc(F)ccc1-c1cn[nH]c1
InChIInChI=1S/C10H9FN2O/c1-14-10-4-8(11)2-3-9(10)7-5-12-13-6-7/h2-6H,1H3,(H,12,13)
InChIKeyWMGKHQMZSGGTAQ-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

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Related Compounds

4-(4-methoxyphenyl)-1H-pyrazol-5-amine
CID 2766938
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464
3-(4-Methoxyphenyl)-1H-Pyrazole
CID 599984
3-(3-Methoxyphenyl)-1H-Pyrazole
CID 2736766
5-(4-Butoxy-phenyl)-4-methyl-1H-pyrazole
CID 11322177
3,4-bis(4-methoxyphenyl)-1H-pyrazole
CID 3835198
(E)-3-fluoro-2-[[4-(4-methyl-1H-pyrazol-5-yl)phenoxy]methyl]prop-2-en-1-amine
CID 146512238
(Z)-3-fluoro-2-[[4-(4-methyl-1H-pyrazol-5-yl)phenoxy]methyl]prop-2-en-1-amine
CID 162369033
3-(2-Methoxyphenyl)-1H-pyrazole
CID 2736764
1-[3-(4-Methoxyphenyl)-1H-pyrazol-4-yl]methanamine
CID 16767326
5-(3-fluoro-4-methoxyphenyl)-4-methyl-1H-pyrazole
CID 1482912
4-(4-ethoxyphenyl)-1H-pyrazol-5-amine
CID 970496

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole (CID 130466751) is 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole is COc1cc(F)ccc1-c1cn[nH]c1.
What is the InChIKey of 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole?
The InChIKey is WMGKHQMZSGGTAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-10-4-8(11)2-3-9(10)7-5-12-13-6-7/h2-6H,1H3,(H,12,13).
What are the key properties of 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole?
4-(4-fluoro-2-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 4-(4-fluoro-2-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 130466751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).