6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine

C13H13F3N2O — CID 63743568

IUPAC6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1c(C)c(C(F)(F)F)nc2ccc(OC)cc12
InChIInChI=1S/C13H13F3N2O/c1-7-11(17-2)9-6-8(19-3)4-5-10(9)18-12(7)13(14,15)16/h4-6H,1-3H3,(H,17,18)
InChIKeyONQUFAYOXTVVRU-UHFFFAOYSA-N
MW270.25 g/mol
LogP3.61
Rot. Bonds2

About 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine

6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine (PubChem CID 63743568) has the molecular formula C13H13F3N2O and a molecular weight of 270.25 g/mol. Its IUPAC name is 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine.

Molecular Properties

Compound Name6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
PubChem CID63743568
Molecular FormulaC13H13F3N2O
Molecular Weight270.25 g/mol
Exact Mass270.10
IUPAC Name6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1c(C)c(C(F)(F)F)nc2ccc(OC)cc12
InChIInChI=1S/C13H13F3N2O/c1-7-11(17-2)9-6-8(19-3)4-5-10(9)18-12(7)13(14,15)16/h4-6H,1-3H3,(H,17,18)
InChIKeyONQUFAYOXTVVRU-UHFFFAOYSA-N
XLogP3.61
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine?
The IUPAC name of 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine (CID 63743568) is 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine.
What is the SMILES notation for 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine?
The canonical SMILES for 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine is CNc1c(C)c(C(F)(F)F)nc2ccc(OC)cc12.
What is the InChIKey of 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine?
The InChIKey is ONQUFAYOXTVVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N2O/c1-7-11(17-2)9-6-8(19-3)4-5-10(9)18-12(7)13(14,15)16/h4-6H,1-3H3,(H,17,18).
What are the key properties of 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine?
6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine has a molecular weight of 270.25 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,3-dimethyl-2-(trifluoromethyl)quinolin-4-amine is sourced from PubChem (CID 63743568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).