6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine

C13H13F3N2O2 — CID 62203940

IUPAC6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1cc(C(F)(F)F)nc2cc(OC)c(OC)cc12
InChIInChI=1S/C13H13F3N2O2/c1-17-8-6-12(13(14,15)16)18-9-5-11(20-3)10(19-2)4-7(8)9/h4-6H,1-3H3,(H,17,18)
InChIKeyIAWQIAJQBXRTSG-UHFFFAOYSA-N
MW286.25 g/mol
LogP3.31
Rot. Bonds3

About 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine

6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine (PubChem CID 62203940) has the molecular formula C13H13F3N2O2 and a molecular weight of 286.25 g/mol. Its IUPAC name is 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine.

Molecular Properties

Compound Name6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine
PubChem CID62203940
Molecular FormulaC13H13F3N2O2
Molecular Weight286.25 g/mol
Exact Mass286.09
IUPAC Name6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine
SMILESCNc1cc(C(F)(F)F)nc2cc(OC)c(OC)cc12
InChIInChI=1S/C13H13F3N2O2/c1-17-8-6-12(13(14,15)16)18-9-5-11(20-3)10(19-2)4-7(8)9/h4-6H,1-3H3,(H,17,18)
InChIKeyIAWQIAJQBXRTSG-UHFFFAOYSA-N
XLogP3.31
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-7-fluoro-6-methoxy-N-methylquinolin-4-amine
CID 103996756
6,7-dimethoxy-N-methyl-2-propan-2-ylquinolin-4-amine
CID 62203943
6-ethyl-N-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 62201831
6,7-dimethoxy-N-methylquinolin-4-amine
CID 62190466
2-ethyl-7-fluoro-6-methoxy-N-methylquinolin-4-amine
CID 113363417
4-chloro-6,7-dimethoxy-2-(trifluoromethyl)quinazoline
CID 22693550
6-chloro-N-methyl-2-(trifluoromethyl)quinolin-4-amine;cyclohexane;4-methoxybenzamide
CID 169218499
N-tert-butyl-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine
CID 21003434
[6,7-dimethoxy-3-methyl-2-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 63744262
6,7-dimethoxy-2-(trifluoromethyl)-3H-quinazolin-4-one
CID 135742363
N-[[4-amino-6-(trifluoromethyl)-2-pyridinyl]methyl]-6,7-dimethoxy-2-methylquinazolin-4-amine
CID 170146414
2,3,6,7-tetramethoxy-9-methylacridine
CID 46187785

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine?
The IUPAC name of 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine (CID 62203940) is 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine.
What is the SMILES notation for 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine?
The canonical SMILES for 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine is CNc1cc(C(F)(F)F)nc2cc(OC)c(OC)cc12.
What is the InChIKey of 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine?
The InChIKey is IAWQIAJQBXRTSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N2O2/c1-17-8-6-12(13(14,15)16)18-9-5-11(20-3)10(19-2)4-7(8)9/h4-6H,1-3H3,(H,17,18).
What are the key properties of 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine?
6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine has a molecular weight of 286.25 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-N-methyl-2-(trifluoromethyl)quinolin-4-amine is sourced from PubChem (CID 62203940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).