4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine

C19H13F4N3O — CID 129093356

IUPAC4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine
SMILESFc1ccc(C2=CN(c3ccc(OC(F)(F)F)cc3)Cc3[nH]ncc32)cc1
InChIInChI=1S/C19H13F4N3O/c20-13-3-1-12(2-4-13)17-10-26(11-18-16(17)9-24-25-18)14-5-7-15(8-6-14)27-19(21,22)23/h1-10H,11H2,(H,24,25)
InChIKeyOVYQULDYPWHCBN-UHFFFAOYSA-N
MW375.33 g/mol
LogP4.86
Rot. Bonds3

About 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine

4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine (PubChem CID 129093356) has the molecular formula C19H13F4N3O and a molecular weight of 375.33 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine
PubChem CID129093356
Molecular FormulaC19H13F4N3O
Molecular Weight375.33 g/mol
Exact Mass375.10
IUPAC Name4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine
SMILESFc1ccc(C2=CN(c3ccc(OC(F)(F)F)cc3)Cc3[nH]ncc32)cc1
InChIInChI=1S/C19H13F4N3O/c20-13-3-1-12(2-4-13)17-10-26(11-18-16(17)9-24-25-18)14-5-7-15(8-6-14)27-19(21,22)23/h1-10H,11H2,(H,24,25)
InChIKeyOVYQULDYPWHCBN-UHFFFAOYSA-N
XLogP4.86
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.33
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrrolo[2,3-c]pyridine
CID 123875701
5-(4-methylsulfonylphenyl)-4-[4-(trifluoromethoxy)phenyl]-1H-pyrazole
CID 19355318
1,2-dimethyl-7-(1-methylpyrazol-4-yl)-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridine
CID 123406044
ethane;1-fluoro-4-methylbenzene;1-methyl-4-(trifluoromethoxy)benzene
CID 144678762
5-phenylmethoxy-4-[4-(trifluoromethoxy)phenyl]-1H-pyrazole
CID 67459181
1-[4-(trifluoromethoxy)phenyl]-2H-tetrazole-5-thione
CID 2732840
1-fluoro-3,5-bis[4-(trifluoromethoxy)phenyl]benzene
CID 164895353
3,5-difluoro-4-[4-(trifluoromethoxy)phenoxy]pyridine
CID 90008186
4-fluoro-N,N-dimethyl-2-[4-(trifluoromethoxy)phenyl]aniline
CID 166640991
1-[4-(trifluoromethoxy)phenyl]-2H-pyridine
CID 151254586
2-fluoro-4,5-bis[4-(trifluoromethoxy)phenyl]pyridine
CID 118829246
2-(4-fluorophenyl)-5-(trifluoromethoxy)aniline
CID 146015322

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine?
The IUPAC name of 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine (CID 129093356) is 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine.
What is the SMILES notation for 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine?
The canonical SMILES for 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine is Fc1ccc(C2=CN(c3ccc(OC(F)(F)F)cc3)Cc3[nH]ncc32)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine?
The InChIKey is OVYQULDYPWHCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F4N3O/c20-13-3-1-12(2-4-13)17-10-26(11-18-16(17)9-24-25-18)14-5-7-15(8-6-14)27-19(21,22)23/h1-10H,11H2,(H,24,25).
What are the key properties of 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine?
4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine has a molecular weight of 375.33 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-6-[4-(trifluoromethoxy)phenyl]-1,7-dihydropyrazolo[5,4-c]pyridine is sourced from PubChem (CID 129093356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).