3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline

C11H6F3N3 — CID 102451668

IUPAC3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline
SMILESFC(F)(F)c1[nH]nc2c1ccc1cccnc12
InChIInChI=1S/C11H6F3N3/c12-11(13,14)10-7-4-3-6-2-1-5-15-8(6)9(7)16-17-10/h1-5H,(H,16,17)
InChIKeySBEWJKAFFPUMOB-UHFFFAOYSA-N
MW237.18 g/mol
LogP3.13
Rot. Bonds

About 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline

3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline (PubChem CID 102451668) has the molecular formula C11H6F3N3 and a molecular weight of 237.18 g/mol. Its IUPAC name is 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline.

Molecular Properties

Compound Name3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline
PubChem CID102451668
Molecular FormulaC11H6F3N3
Molecular Weight237.18 g/mol
Exact Mass237.05
IUPAC Name3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline
SMILESFC(F)(F)c1[nH]nc2c1ccc1cccnc12
InChIInChI=1S/C11H6F3N3/c12-11(13,14)10-7-4-3-6-2-1-5-15-8(6)9(7)16-17-10/h1-5H,(H,16,17)
InChIKeySBEWJKAFFPUMOB-UHFFFAOYSA-N
XLogP3.13
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.18
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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iridium(3+);1,10-phenanthroline
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CID 58385596
CID 58385596
europium;1,10-phenanthroline
CID 20606755
bis(1,10-phenanthroline);ruthenium
CID 15001085
copper(1+);2-(trifluoromethyl)-1,10-phenanthroline
CID 175971875
4-bromo-2-(trifluoromethyl)-1,10-phenanthroline
CID 83399919
copper(1+);1,1,1,2,2-pentafluoroethane;1,10-phenanthroline
CID 118415323
2-[4,5-bis(trifluoromethyl)-2,3-dihydro-1H-imidazol-2-yl]-1,10-phenanthroline
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bis(1,10-phenanthroline);ruthenium(2+);dihexafluorophosphate
CID 175753824

Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline?
The IUPAC name of 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline (CID 102451668) is 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline.
What is the SMILES notation for 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline?
The canonical SMILES for 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline is FC(F)(F)c1[nH]nc2c1ccc1cccnc12.
What is the InChIKey of 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline?
The InChIKey is SBEWJKAFFPUMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F3N3/c12-11(13,14)10-7-4-3-6-2-1-5-15-8(6)9(7)16-17-10/h1-5H,(H,16,17).
What are the key properties of 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline?
3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline has a molecular weight of 237.18 g/mol, XLogP of 3.13, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethyl)-2H-pyrazolo[4,3-h]quinoline is sourced from PubChem (CID 102451668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).