5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole

C10H9FN2O — CID 116869019

IUPAC5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole
SMILESCOc1ccc(F)cc1-c1ccn[nH]1
InChIInChI=1S/C10H9FN2O/c1-14-10-3-2-7(11)6-8(10)9-4-5-12-13-9/h2-6H,1H3,(H,12,13)
InChIKeyAKIREDMYRMAXNN-UHFFFAOYSA-N
MW192.19 g/mol
LogP2.22
Rot. Bonds2

About 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole

5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole (PubChem CID 116869019) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole
PubChem CID116869019
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole
SMILESCOc1ccc(F)cc1-c1ccn[nH]1
InChIInChI=1S/C10H9FN2O/c1-14-10-3-2-7(11)6-8(10)9-4-5-12-13-9/h2-6H,1H3,(H,12,13)
InChIKeyAKIREDMYRMAXNN-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

5-(2-Methoxyphenyl)-1H-1,2,3-triazole
CID 9877511
o-(1H-pyrazol-3-yl)phenol
CID 819511
3,5-bis(4-methoxyphenyl)-1H-pyrazole
CID 658538
5-(4-phenoxyphenyl)-1H-pyrazole
CID 2806138
4-Fluoro-2-(1H-pyrazol-3-yl)phenol
CID 5068606
5-Methoxy-1H-indazole
CID 13346860
3-(2-methoxyphenyl)-1H-pyrazol-5-amine
CID 3240675
3-(4-(4-Fluorophenoxy)phenyl)-1H-pyrazole
CID 9816478
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464
5-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazole
CID 2806185
2-[5-(4-Methoxy-phenyl)-1H-pyrazol-3-yl]-phenol
CID 3750129
4-Methoxy-1H-indazole
CID 24729333

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole (CID 116869019) is 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole is COc1ccc(F)cc1-c1ccn[nH]1.
What is the InChIKey of 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole?
The InChIKey is AKIREDMYRMAXNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-10-3-2-7(11)6-8(10)9-4-5-12-13-9/h2-6H,1H3,(H,12,13).
What are the key properties of 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole?
5-(5-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 5-(5-fluoro-2-methoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 116869019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).