4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline

C11H10F3N — CID 129083834

IUPAC4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline
SMILESC=C1CCNc2ccc(C(F)(F)F)cc21
InChIInChI=1S/C11H10F3N/c1-7-4-5-15-10-3-2-8(6-9(7)10)11(12,13)14/h2-3,6,15H,1,4-5H2
InChIKeyUNXUIGZYRYFLOV-UHFFFAOYSA-N
MW213.20 g/mol
LogP3.53
Rot. Bonds

About 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline

4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline (PubChem CID 129083834) has the molecular formula C11H10F3N and a molecular weight of 213.20 g/mol. Its IUPAC name is 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline.

Molecular Properties

Compound Name4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline
PubChem CID129083834
Molecular FormulaC11H10F3N
Molecular Weight213.20 g/mol
Exact Mass213.08
IUPAC Name4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline
SMILESC=C1CCNc2ccc(C(F)(F)F)cc21
InChIInChI=1S/C11H10F3N/c1-7-4-5-15-10-3-2-8(6-9(7)10)11(12,13)14/h2-3,6,15H,1,4-5H2
InChIKeyUNXUIGZYRYFLOV-UHFFFAOYSA-N
XLogP3.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine;hydrochloride
CID 71432328
6-(trifluoromethyl)-1,2,3,4-tetrahydroquinolin-4-ol
CID 23160669
4,4-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline
CID 105486439
6-(trifluoromethyl)-1,2,3,4-tetrahydroquinolin-4-amine
CID 22735273
butane;4-methylidene-2,3-dihydro-1H-quinoline
CID 143333424
5-(1,1,2,2,2-pentafluoroethyl)-2,3-dihydro-1H-indole
CID 84699877
1-methyl-7-(trifluoromethyl)-4,5-dihydro-3H-1,5-benzodiazepin-2-one
CID 84631098
1-methylidene-6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-isoquinoline
CID 70290228
[6-(trifluoromethyl)-1,2,3,4-tetrahydroquinolin-4-yl]methanol
CID 22735329
3,3-difluoro-6-(trifluoromethyl)-2,4-dihydro-1H-quinoline
CID 22735233
4-bromo-6-(trifluoromethyl)-2,3-dihydro-1H-indole
CID 118862256
5-[4-(1,1-difluoropropyl)phenyl]-2,3-dihydro-1H-indole
CID 143690522

Frequently Asked Questions

What is the IUPAC name of 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline?
The IUPAC name of 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline (CID 129083834) is 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline.
What is the SMILES notation for 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline?
The canonical SMILES for 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline is C=C1CCNc2ccc(C(F)(F)F)cc21.
What is the InChIKey of 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline?
The InChIKey is UNXUIGZYRYFLOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N/c1-7-4-5-15-10-3-2-8(6-9(7)10)11(12,13)14/h2-3,6,15H,1,4-5H2.
What are the key properties of 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline?
4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline has a molecular weight of 213.20 g/mol, XLogP of 3.53, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-6-(trifluoromethyl)-2,3-dihydro-1H-quinoline is sourced from PubChem (CID 129083834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).