5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole

C10H11FN2 — CID 141307712

IUPAC5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole
SMILESCN1CCC(c2ccc(F)cc2)=N1
InChIInChI=1S/C10H11FN2/c1-13-7-6-10(12-13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3
InChIKeyFQSRDKRRNHMMIW-UHFFFAOYSA-N
MW178.21 g/mol
LogP1.87
Rot. Bonds1

About 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole

5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole (PubChem CID 141307712) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole
PubChem CID141307712
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Name5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole
SMILESCN1CCC(c2ccc(F)cc2)=N1
InChIInChI=1S/C10H11FN2/c1-13-7-6-10(12-13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3
InChIKeyFQSRDKRRNHMMIW-UHFFFAOYSA-N
XLogP1.87
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-N-(2,6-dimethylpiperidin-1-yl)-1-(2-fluorophenyl)methanimine
CID 9642770
2-(3-Fluorophenyl)-3,4,5,6-tetrahydro-pyridine
CID 12009050
Acetophenone, dimethylhydrazone
CID 6172446
5-phenyl-3,4-dihydro-2H-pyrrole
CID 261893
3-(2-Fluorophenyl)-2-methyl-5-phenyl-3,4-dihydropyrazole
CID 72164304
3-(3-Fluorophenyl)-2-methyl-5-phenyl-3,4-dihydropyrazole
CID 72164305
3-(4-Fluorophenyl)-2-methyl-5-phenyl-3,4-dihydropyrazole
CID 72164306
(E)-1-(2,4-difluorophenyl)-N-piperidin-1-ylmethanimine
CID 6906562
Hydrazinium, 2-(alpha-methylbenzylidene)-1,1,1-trimethyl-, iodide
CID 9570518
5-(2,5-difluorophenyl)-3,4-dihydro-2H-pyrrole
CID 58335726
3-Phenyl-4,5-dihydro-1H-pyrazole
CID 589745
5-(4-Fluorophenyl)-3,4-dihydropyrazole-2-carbothioamide
CID 46946274

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole?
The IUPAC name of 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole (CID 141307712) is 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole.
What is the SMILES notation for 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole?
The canonical SMILES for 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole is CN1CCC(c2ccc(F)cc2)=N1.
What is the InChIKey of 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole?
The InChIKey is FQSRDKRRNHMMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c1-13-7-6-10(12-13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3.
What are the key properties of 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole?
5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole has a molecular weight of 178.21 g/mol, XLogP of 1.87, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-2-methyl-3,4-dihydropyrazole is sourced from PubChem (CID 141307712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).