7-(trifluoromethyl)-6,7-dihydroquinoline

C10H8F3N — CID 123382262

IUPAC7-(trifluoromethyl)-6,7-dihydroquinoline
SMILESFC(F)(F)C1C=c2ncccc2=CC1
InChIInChI=1S/C10H8F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h1-3,5-6,8H,4H2
InChIKeyKJDFBAXPNXEEQN-UHFFFAOYSA-N
MW199.17 g/mol
LogP1.22
Rot. Bonds

About 7-(trifluoromethyl)-6,7-dihydroquinoline

7-(trifluoromethyl)-6,7-dihydroquinoline (PubChem CID 123382262) has the molecular formula C10H8F3N and a molecular weight of 199.17 g/mol. Its IUPAC name is 7-(trifluoromethyl)-6,7-dihydroquinoline.

Molecular Properties

Compound Name7-(trifluoromethyl)-6,7-dihydroquinoline
PubChem CID123382262
Molecular FormulaC10H8F3N
Molecular Weight199.17 g/mol
Exact Mass199.06
IUPAC Name7-(trifluoromethyl)-6,7-dihydroquinoline
SMILESFC(F)(F)C1C=c2ncccc2=CC1
InChIInChI=1S/C10H8F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h1-3,5-6,8H,4H2
InChIKeyKJDFBAXPNXEEQN-UHFFFAOYSA-N
XLogP1.22
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.17
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-6,7-dihydroquinoline?
The IUPAC name of 7-(trifluoromethyl)-6,7-dihydroquinoline (CID 123382262) is 7-(trifluoromethyl)-6,7-dihydroquinoline.
What is the SMILES notation for 7-(trifluoromethyl)-6,7-dihydroquinoline?
The canonical SMILES for 7-(trifluoromethyl)-6,7-dihydroquinoline is FC(F)(F)C1C=c2ncccc2=CC1.
What is the InChIKey of 7-(trifluoromethyl)-6,7-dihydroquinoline?
The InChIKey is KJDFBAXPNXEEQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h1-3,5-6,8H,4H2.
What are the key properties of 7-(trifluoromethyl)-6,7-dihydroquinoline?
7-(trifluoromethyl)-6,7-dihydroquinoline has a molecular weight of 199.17 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-6,7-dihydroquinoline is sourced from PubChem (CID 123382262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).